COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION

QUICK SEARCH

FULL DB

Total number of items: 1549097
Total number of pages: 1550 ( 1000 items on each page )

Direct access:
1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36, 37, 38, 39, 40, 41, 42, 43, 44, 45, 46, 47, 48, 49, 50, 51, 52, 53, 54, 55, 56, 57, 58, 59, 60, 61, 62, 63, 64, 65, 66, 67, 68, 69, 70, 71, 72, 73, 74, 75, 76, 77, 78, 79, 80, 81, 82, 83, 84, 85, 86, 87, 88, 89, 90, 91, 92, 93, 94, 95, 96, 97, 98, 99, 100, 101, 102, 103, 104, 105, 106, 107, 108, 109, 110, 111, 112, 113, 114, 115, 116, 117, 118, 119, 120, 121, 122, 123, 124, 125, 126, 127, 128, 129, 130, 131, 132, 133, 134, 135, 136, 137, 138, 139, 140, 141, 142, 143, 144, 145, 146, 147, 148, 149, 150, 151, 152, 153, 154, 155, 156, 157, 158, 159, 160, 161, 162, 163, 164, 165, 166, 167, 168, 169, 170, 171, 172, 173, 174, 175, 176, 177, 178, 179, 180, 181, 182, 183, 184, 185, 186, 187, 188, 189, 190, 191, 192, 193, 194, 195, 196, 197, 198, 199, 200, 201, 202, 203, 204, 205, 206, 207, 208, 209, 210, 211, 212, 213, 214, 215, 216, 217, 218, 219, 220, 221, 222, 223, 224, 225, 226, 227, 228, 229, 230, 231, 232, 233, 234, 235, 236, 237, 238, 239, 240, 241, 242, 243, 244, 245, 246, 247, 248, 249, 250, 251, 252, 253, 254, 255, 256, 257, 258, 259, 260, 261, 262, 263, 264, 265, 266, 267, 268, 269, 270, 271, 272, 273, 274, 275, 276, 277, 278, 279, 280, 281, 282, 283, 284, 285, 286, 287, 288, 289, 290, 291, 292, 293, 294, 295, 296, 297, 298, 299, 300, 301, 302, 303, 304, 305, 306, 307, 308, 309, 310, 311, 312, 313, 314, 315, 316, 317, 318, 319, 320, 321, 322, 323, 324, 325, 326, 327, 328, 329, 330, 331, 332, 333, 334, 335, 336, 337, 338, 339, 340, 341, 342, 343, 344, 345, 346, 347, 348, 349, 350, 351, 352, 353, 354, 355, 356, 357, 358, 359, 360, 361, 362, 363, 364, 365, 366, 367, 368, 369, 370, 371, 372, 373, 374, 375, 376, 377, 378, 379, 380, 381, 382, 383, 384, 385, 386, 387, 388, 389, 390, 391, 392, 393, 394, 395, 396, 397, 398, 399, 400, 401, 402, 403, 404, 405, 406, 407, 408, 409, 410, 411, 412, 413, 414, 415, 416, 417, 418, 419, 420, 421, 422, 423, 424, 425, 426, 427, 428, 429, 430, 431, 432, 433, 434, 435, 436, 437, 438, 439, 440, 441, 442, 443, 444, 445, 446, 447, 448, 449, 450, 451, 452, 453, 454, 455, 456, 457, 458, 459, 460, 461, 462, 463, 464, 465, 466, 467, 468, 469, 470, 471, 472, 473, 474, 475, 476, 477, 478, 479, 480, 481, 482, 483, 484, 485, 486, 487, 488, 489, 490, 491, 492, 493, 494, 495, 496, 497, 498, 499, 500, 501, 502, 503, 504, 505, 506, 507, 508, 509, 510, 511, 512, 513, 514, 515, 516, 517, 518, 519, 520, 521, 522, 523, 524, 525, 526, 527, 528, 529, 530, 531, 532, 533, 534, 535, 536, 537, 538, 539, 540, 541, 542, 543, 544, 545, 546, 547, 548, 549, 550, 551, 552, 553, 554, 555, 556, 557, 558, 559, 560, 561, 562, 563, 564, 565, 566, 567, 568, 569, 570, 571, 572, 573, 574, 575, 576, 577, 578, 579, 580, 581, 582, 583, 584, 585, 586, 587, 588, 589, 590, 591, 592, 593, 594, 595, 596, 597, 598, 599, 600, 601, 602, 603, 604, 605, 606, 607, 608, 609, 610, 611, 612, 613, 614, 615, 616, 617, 618, 619, 620, 621, 622, 623, 624, 625, 626, 627, 628, 629, 630, 631, 632, 633, 634, 635, 636, 637, 638, 639, 640, 641, 642, 643, 644, 645, 646, 647, 648, 649, 650, 651, 652, 653, 654, 655, 656, 657, 658, 659, 660, 661, 662, 663, 664, 665, 666, 667, 668, 669, 670, 671, 672, 673, 674, 675, 676, 677, 678, 679, 680, 681, 682, 683, 684, 685, 686, 687, 688, 689, 690, 691, 692, 693, 694, 695, 696, 697, 698, 699, 700, 701, 702, 703, 704, 705, 706, 707, 708, 709, 710, 711, 712, 713, 714, 715, 716, 717, 718, 719, 720, 721, 722, 723, 724, 725, 726, 727, 728, 729, 730, 731, 732, 733, 734, 735, 736, 737, 738, 739, 740, 741, 742, 743, 744, 745, 746, 747, 748, 749, 750, 751, 752, 753, 754, 755, 756, 757, 758, 759, 760, 761, 762, 763, 764, 765, 766, 767, 768, 769, 770, 771, 772, 773, 774, 775, 776, 777, 778, 779, 780, 781, 782, 783, 784, 785, 786, 787, 788, 789, 790, 791, 792, 793, 794, 795, 796, 797, 798, 799, 800, 801, 802, 803, 804, 805, 806, 807, 808, 809, 810, 811, 812, 813, 814, 815, 816, 817, 818, 819, 820, 821, 822, 823, 824, 825, 826, 827, 828, 829, 830, 831, 832, 833, 834, 835, 836, 837, 838, 839, 840, 841, 842, 843, 844, 845, 846, 847, 848, 849, 850, 851, 852, 853, 854, 855, 856, 857, 858, 859, 860, 861, 862, 863, 864, 865, 866, 867, 868, 869, 870, 871, 872, 873, 874, 875, 876, 877, 878, 879, 880, 881, 882, 883, 884, 885, 886, 887, 888, 889, 890, 891, 892, 893, 894, 895, 896, 897, 898, 899, 900, 901, 902, 903, 904, 905, 906, 907, 908, 909, 910, 911, 912, 913, 914, 915, 916, 917, 918, 919, 920, 921, 922, 923, 924, 925, 926, 927, 928, 929, 930, 931, 932, 933 934, 935, 936, 937, 938, 939, 940, 941, 942, 943, 944, 945, 946, 947, 948, 949, 950, 951, 952, 953, 954, 955, 956, 957, 958, 959, 960, 961, 962, 963, 964, 965, 966, 967, 968, 969, 970, 971, 972, 973, 974, 975, 976, 977, 978, 979, 980, 981, 982, 983, 984, 985, 986, 987, 988, 989, 990, 991, 992, 993, 994, 995, 996, 997, 998, 999, 1000, 1001, 1002, 1003, 1004, 1005, 1006, 1007, 1008, 1009, 1010, 1011, 1012, 1013, 1014, 1015, 1016, 1017, 1018, 1019, 1020, 1021, 1022, 1023, 1024, 1025, 1026, 1027, 1028, 1029, 1030, 1031, 1032, 1033, 1034, 1035, 1036, 1037, 1038, 1039, 1040, 1041, 1042, 1043, 1044, 1045, 1046, 1047, 1048, 1049, 1050, 1051, 1052, 1053, 1054, 1055, 1056, 1057, 1058, 1059, 1060, 1061, 1062, 1063, 1064, 1065, 1066, 1067, 1068, 1069, 1070, 1071, 1072, 1073, 1074, 1075, 1076, 1077, 1078, 1079, 1080, 1081, 1082, 1083, 1084, 1085, 1086, 1087, 1088, 1089, 1090, 1091, 1092, 1093, 1094, 1095, 1096, 1097, 1098, 1099, 1100, 1101, 1102, 1103, 1104, 1105, 1106, 1107, 1108, 1109, 1110, 1111, 1112, 1113, 1114, 1115, 1116, 1117, 1118, 1119, 1120, 1121, 1122, 1123, 1124, 1125, 1126, 1127, 1128, 1129, 1130, 1131, 1132, 1133, 1134, 1135, 1136, 1137, 1138, 1139, 1140, 1141, 1142, 1143, 1144, 1145, 1146, 1147, 1148, 1149, 1150, 1151, 1152, 1153, 1154, 1155, 1156, 1157, 1158, 1159, 1160, 1161, 1162, 1163, 1164, 1165, 1166, 1167, 1168, 1169, 1170, 1171, 1172, 1173, 1174, 1175, 1176, 1177, 1178, 1179, 1180, 1181, 1182, 1183, 1184, 1185, 1186, 1187, 1188, 1189, 1190, 1191, 1192, 1193, 1194, 1195, 1196, 1197, 1198, 1199, 1200, 1201, 1202, 1203, 1204, 1205, 1206, 1207, 1208, 1209, 1210, 1211, 1212, 1213, 1214, 1215, 1216, 1217, 1218, 1219, 1220, 1221, 1222, 1223, 1224, 1225, 1226, 1227, 1228, 1229, 1230, 1231, 1232, 1233, 1234, 1235, 1236, 1237, 1238, 1239, 1240, 1241, 1242, 1243, 1244, 1245, 1246, 1247, 1248, 1249, 1250, 1251, 1252, 1253, 1254, 1255, 1256, 1257, 1258, 1259, 1260, 1261, 1262, 1263, 1264, 1265, 1266, 1267, 1268, 1269, 1270, 1271, 1272, 1273, 1274, 1275, 1276, 1277, 1278, 1279, 1280, 1281, 1282, 1283, 1284, 1285, 1286, 1287, 1288, 1289, 1290, 1291, 1292, 1293, 1294, 1295, 1296, 1297, 1298, 1299, 1300, 1301, 1302, 1303, 1304, 1305, 1306, 1307, 1308, 1309, 1310, 1311, 1312, 1313, 1314, 1315, 1316, 1317, 1318, 1319, 1320, 1321, 1322, 1323, 1324, 1325, 1326, 1327, 1328, 1329, 1330, 1331, 1332, 1333, 1334, 1335, 1336, 1337, 1338, 1339, 1340, 1341, 1342, 1343, 1344, 1345, 1346, 1347, 1348, 1349, 1350, 1351, 1352, 1353, 1354, 1355, 1356, 1357, 1358, 1359, 1360, 1361, 1362, 1363, 1364, 1365, 1366, 1367, 1368, 1369, 1370, 1371, 1372, 1373, 1374, 1375, 1376, 1377, 1378, 1379, 1380, 1381, 1382, 1383, 1384, 1385, 1386, 1387, 1388, 1389, 1390, 1391, 1392, 1393, 1394, 1395, 1396, 1397, 1398, 1399, 1400, 1401, 1402, 1403, 1404, 1405, 1406, 1407, 1408, 1409, 1410, 1411, 1412, 1413, 1414, 1415, 1416, 1417, 1418, 1419, 1420, 1421, 1422, 1423, 1424, 1425, 1426, 1427, 1428, 1429, 1430, 1431, 1432, 1433, 1434, 1435, 1436, 1437, 1438, 1439, 1440, 1441, 1442, 1443, 1444, 1445, 1446, 1447, 1448, 1449, 1450, 1451, 1452, 1453, 1454, 1455, 1456, 1457, 1458, 1459, 1460, 1461, 1462, 1463, 1464, 1465, 1466, 1467, 1468, 1469, 1470, 1471, 1472, 1473, 1474, 1475, 1476, 1477, 1478, 1479, 1480, 1481, 1482, 1483, 1484, 1485, 1486, 1487, 1488, 1489, 1490, 1491, 1492, 1493, 1494, 1495, 1496, 1497, 1498, 1499, 1500, 1501, 1502, 1503, 1504, 1505, 1506, 1507, 1508, 1509, 1510, 1511, 1512, 1513, 1514, 1515, 1516, 1517, 1518, 1519, 1520, 1521, 1522, 1523, 1524, 1525, 1526, 1527, 1528, 1529, 1530, 1531, 1532, 1533, 1534, 1535, 1536, 1537, 1538, 1539, 1540, 1541, 1542, 1543, 1544, 1545, 1546, 1547, 1548, 1549, 1550,

Prev 930 931 932 933 934 935 936 937 938 939 Next

STK620715
Synonyms: (5E)- 5- (2H- chromen- 3- ylmethylidene)- 2- (pyridin- 2- ylamino)- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C/C1=Cc2c(OC1)cccc2)Nc1ccccn1

STK620718
Synonyms: (2Z)- 2- (biphenyl- 4- ylmethylidene)- 3- oxo- 7- (pyrrolidinium- 1- ylmethyl)- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: O=C1/C(=C/c2ccc(cc2)c2ccccc2)/Oc2c1ccc(c2C[NH+]1CCCC1)[O-]

STK620721
Synonyms: N~3~- (2- chloro- 7H- purin- 6- yl)- N- [4- (trifluoromethoxy)phenyl]- beta- alaninamide
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CCNc1nc(Cl)nc2c1[nH]cn2

STK620722
Synonyms: N- (furan- 2- ylmethyl)- 2- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)acetamide
Smiles: O=C(Cc1nn2c(n1)nc(cc2O)C)NCc1ccco1

STK620724
Synonyms: 1- hydroxy- 3- methyl- 2- [3- (4- methylpiperazin- 1- yl)- 3- oxopropyl]pyrido[1,2- a]benzimidazole- 4- carbonitrile
Smiles: N#Cc1c(C)c(CCC(=O)N2CCN(CC2)C)c(n2c1nc1c2cccc1)O

STK856270
Synonyms: N- (3,3- diphenylpropyl)- 7H- purin- 6- amine
Smiles: c1ccc(cc1)C(c1ccccc1)CCNc1ncnc2c1[nH]cn2

STK620732
Synonyms: 3- [2- (1,3- benzothiazol- 2- yl)- 5- methyl- 3- oxo- 2,3- dihydro- 1H- pyrazol- 4- yl]- 1- (3- chlorophenyl)pyrrolidine- 2,5- dione
Smiles: Clc1cccc(c1)N1C(=O)CC(C1=O)c1c(C)[nH]n(c1=O)c1nc2c(s1)cccc2

STK620734
Synonyms: (4- methylpiperidin- 1- yl)[2- (1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl]methanone
Smiles: CC1CCN(CC1)C(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK856271
Synonyms: (2Z)- 2- (2- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylacetate
Smiles: CC(=O)Oc1ccc2c(c1)O/C(=C\c1ccccc1F)/C2=O

STK620736
Synonyms: 1- benzyl- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)Cc1ccccc1

STK620738
Synonyms: 5- (3- cyclopropyl- 1H- pyrazol- 5- yl)- 4- (quinolin- 5- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1cccc2c1cccn2)c1[nH]nc(c1)C1CC1

STK620739
Synonyms: (2E)- 6- [(2- chloro- 6- fluorobenzyl)oxy]- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 1- benzofuran- 3(2H)- one
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2C)OCc1c(F)cccc1Cl

STK620740
Synonyms: 2- [(1'- acetyl- 4- oxo- 3,4- dihydrospiro[chromene- 2,4'- piperidin]- 7- yl)oxy]- N- [2- (thiophen- 2- yl)ethyl]acetamide
Smiles: O=C(COc1ccc2c(c1)OC1(CC2=O)CCN(CC1)C(=O)C)NCCc1cccs1

STK620742
Synonyms: 6- (6- benzyl[1,2,4]triazolo[3,4- a]phthalazin- 3- yl)pyridazin- 3- ol
Smiles: Oc1ccc(nn1)c1nnc2n1nc(Cc1ccccc1)c1c2cccc1

STK620745
Synonyms: (2E)- 3- (6- methoxy- 4- oxo- 4H- chromen- 3- yl)prop- 2- enal
Smiles: O=C/C=C/c1coc2c(c1=O)cc(cc2)OC

STK856273
Synonyms: 3- (2- methoxyphenyl)- 7- [(4- nitrobenzyl)oxy]- 4H- chromen- 4- one
Smiles: COc1ccccc1c1coc2c(c1=O)ccc(c2)OCc1ccc(cc1)[N+](=O)[O-]

STK620746
Synonyms: (3R)- 5- oxo- N- (quinolin- 6- yl)- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: O=C([C@@H]1CSC2N1C(=O)c1c2cccc1)Nc1ccc2c(c1)cccn2

STK620752
Synonyms: (2Z)- 8- (pyridin- 3- ylmethyl)- 2- (pyridin- 4- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2ccncc2)/Oc2c1ccc1c2CN(CO1)Cc1cccnc1

STK620753
Synonyms: tert- butyl{[(2Z)- 2- (4- tert- butylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: O=C(OC(C)(C)C)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(C)(C)C)/C2=O

STK856274
Synonyms: (2Z)- 2- (1- benzofuran- 2- ylmethylidene)- 7- [(diethylammonio)methyl]- 4- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: CC[NH+](Cc1c([O-])cc(c2c1O/C(=C\c1cc3c(o1)cccc3)/C2=O)C)CC

STK620756
Synonyms: 2,2- dimethyl- N- (4- methylphenyl)- 5- oxotetrahydrofuran- 3- carboxamide
Smiles: O=C(C1CC(=O)OC1(C)C)Nc1ccc(cc1)C

STK620758
Synonyms: 4- (5- hydroxy- 3- methyl- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 4- yl)benzene- 1,2- diol
Smiles: OC1=C2C(=Nc3c(C2c2ccc(c(c2)O)O)c(C)no3)CCC1

STK620765
Synonyms: 2- (5- methoxy- 4,8,8- trimethyl- 2- oxo- 9,10- dihydro- 2H,8H- pyrano[2,3- f]chromen- 3- yl)- N- (1H- tetrazol- 5- yl)acetamide
Smiles: COc1cc2OC(C)(C)CCc2c2c1c(C)c(CC(=O)Nc1nnn[nH]1)c(=O)o2

STK620766
Synonyms: 2- (1,3- benzothiazol- 2- yl)- 4- butyl- 5- methyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: CCCCc1c(C)[nH]n(c1=O)c1nc2c(s1)cccc2

STK620768
Synonyms: 7- [2- (4- methylpiperazin- 1- yl)- 2- oxoethoxy]- 3- phenyl- 4H- chromen- 4- one
Smiles: CN1CCN(CC1)C(=O)COc1ccc2c(c1)occ(c2=O)c1ccccc1

STK620769
Synonyms: (2Z)- 2- (3,4- dimethoxybenzylidene)- 8- (pyridin- 3- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(ccc1OC)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1cccnc1

STK620771
Synonyms: (2Z)- 2- (3,4- dichlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2- methylpropanoate
Smiles: O=C(C(C)C)Oc1ccc2c(c1)O/C(=C\c1ccc(c(c1)Cl)Cl)/C2=O

STK620773
Synonyms: [2- (1H- benzimidazol- 2- yl)pyrrolidin- 1- yl](pyridin- 3- yl)methanone
Smiles: O=C(N1CCCC1c1nc2c([nH]1)cccc2)c1cccnc1

STK620774
Synonyms: N- (3- chloro- 4- methylphenyl)- 3- [(4S)- 2,5- dioxo- 1- (2- phenylethyl)imidazolidin- 4- yl]propanamide
Smiles: O=C(Nc1ccc(c(c1)Cl)C)CC[C@@H]1NC(=O)N(C1=O)CCc1ccccc1

STK620779
Synonyms: (5E)- 5- [(2- chloro- 6- methoxyquinolin- 3- yl)methylidene]- 3- (4- hydroxyphenyl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1ccc2c(c1)cc(c(n2)Cl)/C=C\1/SC(=S)N(C1=O)c1ccc(cc1)O

STK620785
Synonyms: (2Z)- 2- [(2E)- 3- (2- methoxyphenyl)prop- 2- en- 1- ylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzenesulfonate
Smiles: COc1ccccc1/C=C/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)F

STK620786
Synonyms: 2- [formyl(pyridin- 2- ylmethyl)amino]- N- methylethanesulfonamide
Smiles: O=CN(Cc1ccccn1)CCS(=O)(=O)NC

STK620788
Synonyms: 3- (4- chlorophenyl)- 2- ethyl- 5- (4- methoxyphenyl)pyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCc1nn2c(c1c1ccc(cc1)Cl)nc(cc2O)c1ccc(cc1)OC

STK620790
Synonyms: N- methyl- 4- (pyrimidin- 2- yl)- 1,4- diazepane- 1- carbothioamide
Smiles: CNC(=S)N1CCCN(CC1)c1ncccn1

STK620791
Synonyms: 6- (3- chloro- 4- fluorophenyl)- 3- (propan- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(c1nnc2n1nc(s2)c1ccc(c(c1)Cl)F)C

STK620792
Synonyms: 1- (1,7- dimethyl- 1H- indol- 3- yl)propan- 2- amine
Smiles: CC(Cc1cn(c2c1cccc2C)C)N

STK620798
Synonyms: (3Z)- 3- [(6- methoxy- 1H- indol- 3- yl)methylidene]- 2- methyl- 2,3- dihydro- 4H- 1,2- benzothiazin- 4- one1,1- dioxide
Smiles: COc1ccc2c(c1)[nH]cc2/C=C\1/C(=O)c2ccccc2S(=O)(=O)N1C

STK620802
Synonyms: 6- [1- (2- fluorobiphenyl- 4- yl)ethyl]- 3- (pyrazin- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(c1nn2c(s1)nnc2c1cnccn1)c1ccc(c(c1)F)c1ccccc1

STK620803
Synonyms: 4- amino- 3- cyclopropyl- N- (furan- 2- ylmethyl)- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxamide
Smiles: O=C(c1sc(=S)n(c1N)C1CC1)NCc1ccco1

STK620804
Synonyms: 7- bromo- 4- oxo- N- {4- [4- (propan- 2- yl)phenyl]- 1,2,5- oxadiazol- 3- yl}- 4H- chromene- 2- carboxamide
Smiles: Brc1ccc2c(c1)oc(cc2=O)C(=O)Nc1nonc1c1ccc(cc1)C(C)C

STK620806
Synonyms: 2- [(1'- acetyl- 4- oxo- 3,4- dihydrospiro[chromene- 2,4'- piperidin]- 7- yl)oxy]- N- tert- butylacetamide
Smiles: O=C(NC(C)(C)C)COc1ccc2c(c1)OC1(CC2=O)CCN(CC1)C(=O)C

STK620807
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 1- (2- chloro- 7H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: Clc1ccc2c(c1)c(CCNC(=O)C1CCN(CC1)c1nc(Cl)nc3c1[nH]cn3)c[nH]2

STK620809
Synonyms: 1- (2- chloro- 7H- purin- 6- yl)- N- [2- (3,4- dimethoxyphenyl)ethyl]piperidine- 4- carboxamide
Smiles: COc1cc(CCNC(=O)C2CCN(CC2)c2nc(Cl)nc3c2[nH]cn3)ccc1OC

STK620813
Synonyms: N- [(2S)- 1- [(4- chlorophenyl)amino]- 4- (methylsulfanyl)- 1- oxobutan- 2- yl]- 6,7- dimethoxy- 3,4- dihydroisoquinoline- 2(1H)- carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1ccc(cc1)Cl)NC(=O)N1CCc2c(C1)cc(c(c2)OC)OC

STK620816
Synonyms: N- (4- phenoxyphenyl)- 2- (7H- purin- 6- ylsulfanyl)acetamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)CSc1ncnc2c1[nH]cn2

STK620818
Synonyms: 7- methoxy- N- [2- (pyridin- 4- yl)- 1,3- benzoxazol- 5- yl]- 1- benzofuran- 2- carboxamide
Smiles: COc1cccc2c1oc(c2)C(=O)Nc1ccc2c(c1)nc(o2)c1ccncc1

STK620819
Synonyms: (1S,5S)- 3- [(3- nitrophenyl)sulfonyl]- 1,2,3,4,5,6- hexahydro- 8H- 1,5- methanopyrido[1,2- a][1,5]diazocin- 8- one
Smiles: O=c1cccc2n1C[C@@H]1C[C@H]2CN(C1)S(=O)(=O)c1cccc(c1)[N+](=O)[O-]

STK620820
Synonyms: N- [2- (2,3- dihydro- 1H- inden- 2- ylcarbamoyl)phenyl]- N'- [2- (dimethylamino)ethyl]ethanediamide
Smiles: CN(CCNC(=O)C(=O)Nc1ccccc1C(=O)NC1Cc2c(C1)cccc2)C

STK620822
Synonyms: N- (1,3- benzodioxol- 5- yl)- 2- {[3- (4- chlorophenyl)- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)COc1ccc2c(c1)occ(c2=O)c1ccc(cc1)Cl

STK620827
Synonyms: (2Z)- 2- (2- methylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2,2- dimethylpropanoate
Smiles: O=C(C(C)(C)C)Oc1ccc2c(c1)O/C(=C\c1ccccc1C)/C2=O

STK620831
Synonyms: N- (5- carbamoyl- 1- methyl- 1H- pyrazol- 4- yl)- N'- (4- chlorobenzyl)ethanediamide
Smiles: Clc1ccc(cc1)CNC(=O)C(=O)Nc1cnn(c1C(=O)N)C

STK620836
Synonyms: 1- [4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (thiophen- 2- yl)- 1,3- oxazol- 5- yl]- 4- methylpiperazine
Smiles: CN1CCN(CC1)c1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1cccs1

STK620837
Synonyms: ethyl4- {[2- (2,5- dimethyl- 1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl]carbonyl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)c1ccc2c(c1)sc(n2)n1c(C)ccc1C

STK620838
Synonyms: N'- [4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (2- methoxyphenyl)- 1,3- oxazol- 5- yl]- N,N- dimethylpropane- 1,3- diamine
Smiles: COc1ccccc1c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NCCCN(C)C

STK620839
Synonyms: methyl6- methoxy- 3- ({[2- (morpholin- 4- yl)pyridin- 4- yl]carbonyl}amino)- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)c1ccnc(c1)N1CCOCC1)ccc(c2)OC

STK620840
Synonyms: 2- {[(3- hydroxypropyl)ammonio]methyl}- 4- methyl- 6- oxo- 6H- benzo[c]chromen- 3- olate
Smiles: OCCC[NH2+]Cc1cc2c(c(c1[O-])C)oc(=O)c1c2cccc1

STK620843
Synonyms: 2- methoxy- N- (2- methoxyphenyl)- 5- (4- methyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)Nc1ccccc1OC)N1C(=O)C(CS1(=O)=O)C

STK620844
Synonyms: (2Z)- 2- (3- chlorobenzylidene)- 8- (pyridin- 4- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: Clc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccncc1

STK620846
Synonyms: methylN- [(4- methoxyphenyl)carbamoyl]- L- phenylalaninate
Smiles: COC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccc(cc1)OC

STK856283
Synonyms: N- {2- [(4- chlorophenyl)carbonyl]- 3- methyl- 1- benzofuran- 6- yl}cyclopropanecarboxamide
Smiles: O=C(C1CC1)Nc1ccc2c(c1)oc(c2C)C(=O)c1ccc(cc1)Cl

STK620847
Synonyms: N- {2- [(pyridin- 4- ylcarbonyl)amino]ethyl}- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)sc(n2)n1cccc1)NCCNC(=O)c1ccncc1

STK856285
Synonyms: N- tert- butyl- 2- {[6- tert- butyl- 3- cyano- 4- (trifluoromethyl)pyridin- 2- yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)NC(C)(C)C)nc(cc1C(F)(F)F)C(C)(C)C

STK620848
Synonyms: 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- (2- phenylethyl)- 4,5,6,7- tetrahydro- 1H- indazole- 3- carboxamide
Smiles: O=C(c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1)NCCc1ccccc1

STK620851
Synonyms: N- (1,3- dihydroxy- 2- methylpropan- 2- yl)- 2- [(5- hydroxy- 4- oxo- 2- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: OCC(NC(=O)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1)(CO)C

STK620853
Synonyms: {2,6- dichloro- 4- [(E)- {4- hydroxy- 2,6- dioxo- 1- [4- (propan- 2- yl)phenyl]- 1,6- dihydropyrimidin- 5(2H)- ylidene}methyl]phenoxy}aceticacid
Smiles: OC(=O)COc1c(Cl)cc(cc1Cl)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)C(C)C)O

STK620855
Synonyms: (2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 6- [(2- fluorobenzyl)oxy]- 7- methyl- 1- benzofuran- 3(2H)- one
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2C)OCc1ccccc1F

STK620857
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidine- 2- carboxamide
Smiles: Cc1cc(O)n2c(n1)nc(n2)C(=O)Nc1ccc2c(c1)OCCO2

STK620859
Synonyms: 4- (4,5- dimethyl- 1,3- thiazol- 2- yl)- 5- imino- 1- (propan- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: CC(N1CC(=C(C1=N)c1sc(c(n1)C)C)O)C

STK620860
Synonyms: N- [(1S)- 1- phenylethyl]- 1- (pyrimidin- 2- yl)piperidine- 3- carboxamide
Smiles: C[C@@H](c1ccccc1)NC(=O)C1CCCN(C1)c1ncccn1

STK620861
Synonyms: 6- benzyl- 3- (2,5- difluorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Fc1ccc(c(c1)c1nnc2n1nc(s2)Cc1ccccc1)F

STK620864
Synonyms: N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- [2- (5- methoxy- 1H- indol- 3- yl)ethyl]glycinamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)CNC(=O)Cc1nnc(c3c1cccc3)O)c[nH]2

STK620868
Synonyms: 2- chloro- N- (2- methoxyethyl)- 7H- purin- 6- amine
Smiles: COCCNc1nc(Cl)nc2c1[nH]cn2

STK856287
Synonyms: 1- (2,1,3- benzothiadiazol- 4- ylsulfonyl)- N- cyclopentylpiperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)S(=O)(=O)c1cccc2c1nsn2)NC1CCCC1

STK620871
Synonyms: [3- (2- chlorobenzyl)- 1,7- dimethyl- 2,4- dioxo- 1,2,3,4- tetrahydro- 8H- imidazo[2,1- f]purin- 8- yl]aceticacid
Smiles: OC(=O)Cn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccccc1Cl

STK620872
Synonyms: 2- {(5E)- 2,4- dioxo- 5- [(2E)- 3- phenylprop- 2- en- 1- ylidene]- 1,3- thiazolidin- 3- yl}- N- [(3S,4R)- 4- hydroxytetrahydrothiophen- 3- yl]acetamide
Smiles: O=C(CN1C(=O)S/C(=C/C=C/c2ccccc2)/C1=O)N[C@@H]1CSC[C@@H]1O

STK620874
Synonyms: 3- (3- chlorophenyl)- 1- (3,4- dimethoxyphenyl)- 1- (furan- 2- ylmethyl)urea
Smiles: COc1cc(ccc1OC)N(C(=O)Nc1cccc(c1)Cl)Cc1ccco1

STK620875
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 6- [(3- methoxybenzyl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: COc1cccc(c1)COc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O

STK620877
Synonyms: ethyl2- (1,3- benzothiazol- 2- yl)- 3- oxo- 2,3- dihydro- 1H- pyrazole- 4- carboxylate
Smiles: CCOC(=O)c1c[nH]n(c1=O)c1nc2c(s1)cccc2

STK620879
Synonyms: 4- (1H- indol- 3- yl)- N- (pyridin- 2- yl)butanamide
Smiles: O=C(Nc1ccccn1)CCCc1c[nH]c2c1cccc2

STK620886
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 5- (2,5- difluorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccc(c(c1)c1n[nH]c(=S)n1c1ccc2c(c1)OCO2)F

STK620887
Synonyms: 4- (3,4- dichlorophenyl)- 3- methyl- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 5- ol
Smiles: OC1=C2C(=Nc3c(C2c2ccc(c(c2)Cl)Cl)c(C)no3)CCC1

STK620889
Synonyms: N- [2- (1- benzylpiperidin- 4- yl)ethyl]- 1- (pyrimidin- 2- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ncccn1)NCCC1CCN(CC1)Cc1ccccc1

STK620890
Synonyms: 1- [3- (1H- indol- 3- yl)propanoyl]- N- phenylpiperidine- 3- carboxamide
Smiles: O=C(N1CCCC(C1)C(=O)Nc1ccccc1)CCc1c[nH]c2c1cccc2

STK620891
Synonyms: 2- {[5- cyano- 3,3- dimethyl- 8- (piperazin- 1- yl)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridin- 6- yl]sulfanyl}- N- (2,4- dimethoxyphenyl)acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2OC)OC)nc(c2c1CC(C)(C)OC2)N1CCNCC1

STK620892
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2,2- dimethylpropanoate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OC(=O)C(C)(C)C)cn2C

STK620893
Synonyms: 2- hydroxy- 5- (naphthalen- 1- yl)- 1- propylpyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: CCCn1c(O)nc(=O)c2c1nccc2c1cccc2c1cccc2

STK620895
Synonyms: 2- (5,7- dimethoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- (2,2,6,6- tetramethylpiperidin- 4- yl)acetamide
Smiles: COc1cc(OC)cc2c1c(C)c(c(=O)o2)CC(=O)NC1CC(C)(C)NC(C1)(C)C

STK856288
Synonyms: propan- 2- yl5- {[(3,4- dimethoxyphenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COc1cc(ccc1OC)C(=O)Oc1ccc2c(c1)c(C(=O)OC(C)C)c(o2)C

STK620898
Synonyms: 1- amino- 5- (4- chlorophenyl)- 7,8,9,10- tetrahydropyrimido[4,5- c]isoquinolin- 6(5H)- one
Smiles: Clc1ccc(cc1)n1c(=O)c2CCCCc2c2c1ncnc2N

STK620899
Synonyms: 4- (4- chlorobenzyl)- 2- (4- fluorophenyl)- 5- methyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Fc1ccc(cc1)n1[nH]c(c(c1=O)Cc1ccc(cc1)Cl)C

STK620901
Synonyms: N- (1,5- dimethyl- 3- oxo- 2- phenyl- 2,3- dihydro- 1H- pyrazol- 4- yl)- 3- (7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)propanamide
Smiles: O=C(Nc1c(=O)n(n(c1C)C)c1ccccc1)CCc1c(=O)oc2c(c1C)ccc(c2)O

STK620903
Synonyms: (2Z)- 8- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 2- (2,3- dimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1c(cccc1OC)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)c1ccc2c(c1)OCCO2

STK620906
Synonyms: 2- chloro- N- (3- phenylpropyl)- 7H- purin- 6- amine
Smiles: Clc1nc(NCCCc2ccccc2)c2c(n1)nc[nH]2

STK620909
Synonyms: methyl2- {(3E)- 3- [(2- methyl- 2H- chromen- 3- yl)methylidene]- 2,5- dioxopyrrolidin- 1- yl}- 4,5,6,7- tetrahydro- 1- benzothiophene- 3- carboxylate
Smiles: COC(=O)c1c(sc2c1CCCC2)N1C(=O)C/C(=C\C2=Cc3ccccc3OC2C)/C1=O

STK620911
Synonyms: 5- oxo- 6- propyl- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidin- 7- ylbenzoate
Smiles: CCCc1c(OC(=O)c2ccccc2)nc2n(c1=O)CCS2

STK620912
Synonyms: 4- amino- 3- cyclopropyl- 2- thioxo- 2,3- dihydro- 1,3- thiazole- 5- carboxamide
Smiles: NC(=O)c1sc(=S)n(c1N)C1CC1

STK620913
Synonyms: 2- (4- fluorophenyl)- 5- (4- methoxyphenyl)- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccc(cc1)c1[nH]n(c(=O)c1)c1ccc(cc1)F

STK620914
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylacetate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OC(=O)C)cn2C

STK620915
Synonyms: 6- chloro- 3- (furan- 2- ylmethyl)- 1,3- dihydro- 2H- indol- 2- one
Smiles: O=C1Nc2c(C1Cc1ccco1)ccc(c2)Cl

STK620917
Synonyms: 1- [2- (1H- indol- 2- yl)ethyl]tetrahydro- 1H- thieno[3,4- d]imidazole- 2(3H)- thione5,5- dioxide
Smiles: S=C1NC2C(N1CCc1cc3c([nH]1)cccc3)CS(=O)(=O)C2

STK620922
Synonyms: (2Z)- 2- (2- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl(2E)- 3- phenylprop- 2- enoate
Smiles: O=C(Oc1ccc2c(c1)O/C(=C\c1ccccc1F)/C2=O)/C=C/c1ccccc1

STK620923
Synonyms: 8,9- dimethyl- 7- (1,3- thiazol- 2- yl)- 2- (thiophen- 2- yl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1n(c2nccs2)c2c(c1C)c1nc(nn1cn2)c1cccs1

STK620925
Synonyms: N- (4- {(5Z)- 5- [(5- methoxy- 1H- indol- 3- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}phenyl)acetamide
Smiles: COc1ccc2c(c1)c(c[nH]2)/C=C/1\SC(=S)N(C1=O)c1ccc(cc1)NC(=O)C

STK620927
Synonyms: 2- [(5Z)- 5- (3- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [3- (1H- imidazol- 1- yl)propyl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2cccc(c2)F)/C1=O)NCCCn1cncc1

STK620928
Synonyms: N- [2- (1H- imidazol- 5- yl)ethyl]- 1- (5- nitropyridin- 2- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ccc(cn1)[N+](=O)[O-])NCCc1cnc[nH]1

STK620932
Synonyms: 4- {[2- (1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl]carbonyl}piperazin- 2- one
Smiles: O=C1NCCN(C1)C(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK620935
Synonyms: 3- {4- [2- (2- fluorophenoxy)ethyl]piperazin- 1- yl}- 1,2- benzothiazole
Smiles: Fc1ccccc1OCCN1CCN(CC1)c1nsc2c1cccc2

STK620936
Synonyms: 2- (4- {(Z)- [1- (3,5- dimethylphenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}phenoxy)propanoicacid
Smiles: OC(=O)C(Oc1ccc(cc1)/C=C\1/C(=NC(=O)N(C1=O)c1cc(C)cc(c1)C)O)C

STK620938
Synonyms: N,N- dibenzyl- 3- (6- nitro- 1H- benzimidazol- 2- yl)propanamide
Smiles: O=C(N(Cc1ccccc1)Cc1ccccc1)CCc1nc2c([nH]1)cc(cc2)[N+](=O)[O-]

STK620941
Synonyms: 2- [(4- chlorophenoxy)methyl]- 8,9- dimethyl- 7- (pyridin- 2- ylmethyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Clc1ccc(cc1)OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)Cc1ccccn1

STK856294
Synonyms: N- {3- [1- acetyl- 5- (thiophen- 2- yl)- 4,5- dihydro- 1H- pyrazol- 3- yl]phenyl}acetamide
Smiles: CC(=O)Nc1cccc(c1)C1=NN(C(C1)c1cccs1)C(=O)C

STK620943
Synonyms: (3R)- N- (4- chloro- 3- nitrophenyl)- 2,2- dimethyl- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: [O-][N+](=O)c1cc(ccc1Cl)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1

STK620950
Synonyms: 1H- indol- 2- yl[3- (thiomorpholin- 4- ylcarbonyl)piperidin- 1- yl]methanone
Smiles: O=C(C1CCCN(C1)C(=O)c1cc2c([nH]1)cccc2)N1CCSCC1

STK620952
Synonyms: N- [3- (1H- imidazol- 1- yl)propyl]- 1- (5- nitropyridin- 2- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ccc(cn1)[N+](=O)[O-])NCCCn1cncc1

STK620953
Synonyms: 6- ({4- (dimethylamino)- 6- [methoxy(methyl)amino]- 1,3,5- triazin- 2- yl}oxy)- 2- methylpyridazin- 3(2H)- one
Smiles: CON(c1nc(Oc2ccc(=O)n(n2)C)nc(n1)N(C)C)C

STK620956
Synonyms: 3- [2- (1,3- benzothiazol- 2- yl)- 5- methyl- 3- oxo- 2,3- dihydro- 1H- pyrazol- 4- yl]- 1- (2- methoxyphenyl)pyrrolidine- 2,5- dione
Smiles: COc1ccccc1N1C(=O)CC(C1=O)c1c(C)[nH]n(c1=O)c1nc2c(s1)cccc2

STK620957
Synonyms: (2Z)- 3- oxo- 2- [(2E)- 3- phenylprop- 2- en- 1- ylidene]- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzenesulfonate
Smiles: Fc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\C=C\c1ccccc1)/C2=O

STK620962
Synonyms: N- (3- phenylpropyl)- 1- (9H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)NCCCc1ccccc1

STK620963
Synonyms: 3- benzyl- 5,6- dimethyl- 7- (1,3- thiazol- 2- yl)- 3,7- dihydro- 4H- pyrrolo[2,3- d]pyrimidin- 4- imine
Smiles: Cc1c(C)n(c2c1c(=N)n(cn2)Cc1ccccc1)c1nccs1

STK620968
Synonyms: N- (2- hydroxy- 2- phenylethyl)- 6- oxo- 1- phenyl- 1,4,5,6- tetrahydropyridazine- 3- carboxamide
Smiles: OC(c1ccccc1)CNC(=O)C1=NN(C(=O)CC1)c1ccccc1

STK620969
Synonyms: methyl3- [(E)- (3- methyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1/C=C\1/SC(=S)N(C1=O)C)cccc2

STK620970
Synonyms: (2E)- 2- [(1- ethyl- 5- methoxy- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzoate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OC(=O)c1ccc(cc1)Cl)cn2CC

STK620971
Synonyms: (5Z)- 3- (2- phenylethyl)- 5- (quinolin- 8- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C\c2cccc3c2nccc3)/C(=O)N1CCc1ccccc1

STK620973
Synonyms: N- (4- sulfamoylbenzyl)- 2- (2,3,4,9- tetramethyl- 7- oxo- 7H- furo[2,3- f]chromen- 8- yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)c1oc(c(c1c(c2)C)C)C)NCc1ccc(cc1)S(=O)(=O)N

STK620974
Synonyms: 5- (furan- 2- yl)- 4- [3- (morpholin- 4- yl)propyl]- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1CCCN1CCOCC1)c1ccco1

STK620976
Synonyms: 8,9- dimethyl- 7- (pyridin- 4- ylmethyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1c(C)n(c2c1c1ncnn1cn2)Cc1ccncc1

STK620977
Synonyms: (2- {2- [(3- methoxyphenyl)amino]- 2- oxoethoxy}phenyl)phosphonicacid
Smiles: COc1cccc(c1)NC(=O)COc1ccccc1P(=O)(O)O

STK620978
Synonyms: 4- (2,1,3- benzoxadiazol- 4- yl)- 5- (4- methoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1)c1n[nH]c(=S)n1c1cccc2c1non2

STK856295
Synonyms: (5E)- 3- (3,5- dimethylphenyl)- 6- hydroxy- 5- {[5- (2- methyl- 5- nitrophenyl)furan- 2- yl]methylidene}pyrimidine- 2,4(3H,5H)- dione
Smiles: Cc1cc(C)cc(c1)N1C(=O)N=C(/C(=C\c2ccc(o2)c2cc(ccc2C)[N+](=O)[O-])/C1=O)O

STK620981
Synonyms: (3aS,6aR)- 3- (1,5- dimethyl- 1H- pyrazol- 4- yl)- 5- (3- nitrophenyl)- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: O=C1N(c2cccc(c2)[N+](=O)[O-])C(=O)[C@H]2[C@@H]1C(=NO2)c1cnn(c1C)C

STK620984
Synonyms: 3- {4- [3- (4- fluorophenoxy)propyl]piperazin- 1- yl}- 1,2- benzothiazole
Smiles: Fc1ccc(cc1)OCCCN1CCN(CC1)c1nsc2c1cccc2

STK620985
Synonyms: N- [3- (1H- benzimidazol- 2- yl)- 4,5- dimethyl- 1- propyl- 1H- pyrrol- 2- yl]- 2- methylpropanamide
Smiles: CCCn1c(C)c(c(c1NC(=O)C(C)C)c1nc2c([nH]1)cccc2)C

STK620991
Synonyms: 3- [4- (2- phenoxyethyl)piperazin- 1- yl]- 1,2- benzothiazole
Smiles: c1ccc(cc1)OCCN1CCN(CC1)c1nsc2c1cccc2

STK620993
Synonyms: N- phenyl- 1- (7H- purin- 6- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ncnc2c1[nH]cn2)Nc1ccccc1

STK620995
Synonyms: N- (2,3- dihydro- 1H- inden- 2- yl)- 2- [(9- oxo- 1,2,3,9- tetrahydropyrrolo[2,1- b]quinazolin- 7- yl)oxy]acetamide
Smiles: O=C(NC1Cc2c(C1)cccc2)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK620997
Synonyms: [4- (4- fluorophenyl)piperazin- 1- yl][1- (pyrimidin- 2- yl)piperidin- 4- yl]methanone
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)C1CCN(CC1)c1ncccn1

STK620999
Synonyms: 2- hydroxy- 7,7- dimethyl- 5- oxo- 5,6,7,8- tetrahydroquinoline- 3- carboxylicacid
Smiles: O=C1CC(C)(C)Cc2c1cc(C(=O)O)c(n2)O

STK621000
Synonyms: N- [(1- ethylpyrrolidin- 2- yl)methyl]- 1- (7H- purin- 6- yl)piperidine- 3- carboxamide
Smiles: CCN1CCCC1CNC(=O)C1CCCN(C1)c1ncnc2c1[nH]cn2

STK621002
Synonyms: ethyl{[2- methyl- 4- oxo- 3- (2- phenyl- 1,3- thiazol- 4- yl)- 4H- chromen- 7- yl]oxy}acetate
Smiles: CCOC(=O)COc1ccc2c(c1)oc(c(c2=O)c1csc(n1)c1ccccc1)C

STK621003
Synonyms: (2Z)- 2- [(6- bromo- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 6- [(2- methylprop- 2- en- 1- yl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: CC(=C)COc1ccc2c(c1)O/C(=C\c1cc(Br)cc3c1OCOC3)/C2=O

STK621006
Synonyms: N- (3- hydroxyphenyl)- 2- [(2- methyl- 4- oxo- 3- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: O=C(Nc1cccc(c1)O)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK621007
Synonyms: N- (4- fluorophenyl)- N- [(4- methyl- 5- thioxo- 4,5- dihydro- 1H- 1,2,4- triazol- 3- yl)methyl]methanesulfonamide
Smiles: Fc1ccc(cc1)N(S(=O)(=O)C)Cc1n[nH]c(=S)n1C

STK621008
Synonyms: 7- methoxy- N- [(5- phenyl- 1,2,4- oxadiazol- 3- yl)methyl]- 1- benzofuran- 2- carboxamide
Smiles: COc1cccc2c1oc(c2)C(=O)NCc1noc(n1)c1ccccc1

STK621010
Synonyms: [5- amino- 2- (4- methoxyphenyl)- 4- methylthieno[2,3- d]pyrimidin- 6- yl](piperidin- 1- yl)methanone
Smiles: COc1ccc(cc1)c1nc(C)c2c(n1)sc(c2N)C(=O)N1CCCCC1

STK621013
Synonyms: N- [3- methyl- 2- (phenylcarbonyl)- 1- benzofuran- 5- yl]- 3- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)c(C)c(o2)C(=O)c1ccccc1)CCn1nnc2c(c1=O)cccc2

STK621016
Synonyms: N- {2- [(4- methoxyphenyl)carbonyl]- 3- methyl- 1- benzofuran- 5- yl}- 3- (4- oxoquinazolin- 3(4H)- yl)propanamide
Smiles: COc1ccc(cc1)C(=O)c1oc2c(c1C)cc(cc2)NC(=O)CCn1cnc2c(c1=O)cccc2

STK621017
Synonyms: N- [3- (morpholin- 4- yl)propyl]- 1H- indole- 5- carboxamide
Smiles: O=C(c1ccc2c(c1)cc[nH]2)NCCCN1CCOCC1

STK621018
Synonyms: 1- (3,4- difluorophenyl)- N- [3- (morpholin- 4- yl)propyl]- 1H- pyrazolo[3,4- d]pyrimidin- 4- amine
Smiles: Fc1ccc(cc1F)n1ncc2c1ncnc2NCCCN1CCOCC1

STK621026
Synonyms: ethyl2- (4- methoxyphenyl)- 5- {[(3- methoxyphenyl)carbonyl]oxy}- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)c1c(oc2c1cc(cc2)OC(=O)c1cccc(c1)OC)c1ccc(cc1)OC

STK621028
Synonyms: N- [3- methyl- 2- (phenylcarbonyl)- 1- benzofuran- 6- yl]- 4- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)butanamide
Smiles: O=C(Nc1ccc2c(c1)oc(c2C)C(=O)c1ccccc1)CCCn1nnc2c(c1=O)cccc2

STK621030
Synonyms: N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)- 1- benzofuran- 2- carboxamide
Smiles: O=C(c1cc2c(o1)cccc2)NC1C=CS(=O)(=O)C1

STK856299
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 2,8- dimethyl- 4- oxo- 4H- chromen- 7- ylfuran- 2- carboxylate
Smiles: O=C(c1ccco1)Oc1ccc2c(c1C)oc(c(c2=O)c1nc2c(s1)cccc2)C

STK621031
Synonyms: 2- [4- (4- cyano- 1- phenyl- 5,6,7,8- tetrahydroisoquinolin- 3- yl)piperazin- 1- yl]- N- (2- methoxyethyl)- 2- oxoacetamide
Smiles: COCCNC(=O)C(=O)N1CCN(CC1)c1nc(c2ccccc2)c2c(c1C#N)CCCC2

STK621032
Synonyms: 2- {[6- (difluoromethoxy)- 1H- benzimidazol- 2- yl]sulfanyl}- N- (3- hydroxyphenyl)acetamide
Smiles: O=C(Nc1cccc(c1)O)CSc1nc2c([nH]1)cc(cc2)OC(F)F

STK621034
Synonyms: 2- (methoxymethyl)- 6H- spiro[benzo[h]quinazoline- 5,1'- cyclopentan]- 4- ol
Smiles: COCc1nc(O)c2c(n1)c1ccccc1CC12CCCC1

STK621035
Synonyms: 4- (2,1,3- benzoxadiazol- 4- yl)- 5- (4- methoxybenzyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1)Cc1n[nH]c(=S)n1c1cccc2c1non2

STK621036
Synonyms: (2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2- fluorobenzoate
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2)OC(=O)c1ccccc1F

STK621039
Synonyms: methyl4- [(1,1- dioxidotetrahydrothiophen- 3- yl)amino]butanoate
Smiles: COC(=O)CCCNC1CCS(=O)(=O)C1

STK621043
Synonyms: (5Z)- 3- (2,4- dimethoxyphenyl)- 5- (quinolin- 8- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1cc(OC)ccc1N1C(=S)S/C(=C\c2cccc3c2nccc3)/C1=O

STK621045
Synonyms: (5S)- 3- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 5- [3- oxo- 3- (pyrrolidin- 1- yl)propyl]imidazolidine- 2,4- dione
Smiles: Clc1ccc2c(c1)c(CCN1C(=O)N[C@H](C1=O)CCC(=O)N1CCCC1)c[nH]2

STK621048
Synonyms: ethyl(2Z)- 4- {[3- (4- bromophenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}but- 2- enoate
Smiles: CCOC(=O)/C=C\COc1ccc2c(c1)oc(c(c2=O)c1ccc(cc1)Br)C

STK621049
Synonyms: N- [4- (4- ethyl- 4'- oxo- 1',4'- dihydro- 3'H- spiro[cyclohexane- 1,2'- quinazolin]- 3'- yl)phenyl]acetamide
Smiles: CCC1CCC2(CC1)Nc1ccccc1C(=O)N2c1ccc(cc1)NC(=O)C

STK621050
Synonyms: 7- hydroxy- 6- (2- methylpropyl)- 2,3- dihydro- 5H- [1,3]thiazolo[3,2- a]pyrimidin- 5- one
Smiles: CC(Cc1c(O)nc2n(c1=O)CCS2)C

STK621051
Synonyms: (3Z)- 1- (4- methoxyphenyl)- 3- [(1- methyl- 1H- indol- 3- yl)methylidene]pyrrolidine- 2,5- dione
Smiles: COc1ccc(cc1)N1C(=O)C/C(=C/c2cn(c3c2cccc3)C)/C1=O

STK621054
Synonyms: N- (pyridin- 3- ylmethyl)- N'- [2- (pyrrolidin- 1- ylcarbonyl)phenyl]ethanediamide
Smiles: O=C(C(=O)Nc1ccccc1C(=O)N1CCCC1)NCc1cccnc1

STK856300
Synonyms: N'- [(1E)- 2,3,4,5,6- pentahydroxyhexylidene]pyridine- 4- carbohydrazide(non- preferredname)
Smiles: OCC(C(C(C(/C=N/NC(=O)c1ccncc1)O)O)O)O

STK621058
Synonyms: 1- (3,4- dimethoxybenzyl)- 3- methyl- 1- [3- (morpholin- 4- yl)propyl]thiourea
Smiles: CNC(=S)N(Cc1ccc(c(c1)OC)OC)CCCN1CCOCC1

STK621064
Synonyms: methyl2- {[(3- hydroxy- 1,2- dihydroquinoxalin- 2- yl)acetyl]amino}- 5- methylthiophene- 3- carboxylate
Smiles: COC(=O)c1cc(sc1NC(=O)CC1Nc2ccccc2N=C1O)C

STK621065
Synonyms: methylN- [(2,5- dimethoxyphenyl)carbamoyl]- L- tryptophanate
Smiles: COC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)Nc1cc(OC)ccc1OC

STK621067
Synonyms: 7- [(2,6- difluorobenzyl)oxy]- 2,3- dihydropyrrolo[2,1- b]quinazolin- 9(1H)- one
Smiles: Fc1cccc(c1COc1ccc2c(c1)c(=O)n1c(n2)CCC1)F

STK621070
Synonyms: N- [(2S)- 1- (1,3- benzodioxol- 5- ylamino)- 1- oxopropan- 2- yl]- 5- ethyl- 8- oxo- 5,8- dihydro[1,3]dioxolo[4,5- g]quinoline- 7- carboxamide
Smiles: CCn1cc(C(=O)N[C@H](C(=O)Nc2ccc3c(c2)OCO3)C)c(=O)c2c1cc1OCOc1c2

STK621072
Synonyms: 2- (4- hydroxyphthalazin- 1- yl)- N- [2- (4- methylpiperazin- 1- yl)- 2- oxoethyl]acetamide
Smiles: CN1CCN(CC1)C(=O)CNC(=O)Cc1nnc(c2c1cccc2)O

STK621074
Synonyms: (2Z)- 2- (4- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylcyclohexanecarboxylate
Smiles: O=C(C1CCCCC1)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)Br)/C2=O

STK621075
Synonyms: ethyl4- {[1- cyclopropyl- 7- (4- ethylpiperazin- 1- yl)- 6- fluoro- 4- oxo- 1,4- dihydroquinolin- 3- yl]carbonyl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)c1cn(C2CC2)c2c(c1=O)cc(c(c2)N1CCN(CC1)CC)F

STK621076
Synonyms: ethyl4- (2- amino- 7H- purin- 6- yl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1nc(N)nc2c1[nH]cn2

STK621080
Synonyms: 2- (2- chlorophenyl)- 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- N- [3- (1H- imidazol- 1- yl)propyl]- 1,3- oxazol- 5- amine
Smiles: Clc1ccccc1c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NCCCn1ccnc1

STK621081
Synonyms: N- [3- (dimethylamino)propyl]- 1- (9H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: CN(CCCNC(=O)C1CCN(CC1)c1ncnc2c1nc[nH]2)C

STK621083
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- N'- (5- methyl- 1,2- oxazol- 3- yl)ethanediamide
Smiles: Clc1ccc2c(c1)c(CCNC(=O)C(=O)Nc1noc(c1)C)c[nH]2

STK621086
Synonyms: 3- [3- (4- methoxybenzyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]- 1H- indole
Smiles: COc1ccc(cc1)Cc1nnc2n1nc(s2)c1c[nH]c2c1cccc2

STK621087
Synonyms: (2Z)- 8- [2- (3,4- dimethoxyphenyl)ethyl]- 2- (pyridin- 4- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(CCN2COc3c(C2)c2O/C(=C\c4ccncc4)/C(=O)c2cc3)ccc1OC

STK621088
Synonyms: (5E)- 3- (2- methoxyphenyl)- 5- (quinoxalin- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1ccccc1N1C(=S)S/C(=C/c2cnc3c(n2)cccc3)/C1=O

STK621089
Synonyms: 3- amino- 2- (furan- 2- ylmethyl)- 1- thioxo- 1,2,5,6,7,8- hexahydroisoquinoline- 4- carbonitrile
Smiles: N#Cc1c(N)n(Cc2ccco2)c(=S)c2c1CCCC2

STK621092
Synonyms: 2- {3- [(4- chlorophenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl}quinoline
Smiles: Clc1ccc(cc1)OCc1nnc2n1nc(s2)c1ccc2c(n1)cccc2

STK621093
Synonyms: N- ({4- [3- (1H- indol- 3- yl)propanoyl]piperazin- 1- yl}carbonyl)- L- alanine
Smiles: OC(=O)[C@@H](NC(=O)N1CCN(CC1)C(=O)CCc1c[nH]c2c1cccc2)C

STK621094
Synonyms: 3- (1,3- benzodioxol- 5- yl)- 6- [(E)- 2- (4- methoxyphenyl)ethenyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1ccc(cc1)/C=C/c1nn2c(s1)nnc2c1ccc2c(c1)OCO2

STK856304
Synonyms: N- {2- [(2,5- dimethoxyphenyl)carbonyl]- 3- methyl- 1- benzofuran- 6- yl}- 3,4- dimethoxybenzamide
Smiles: COc1ccc(c(c1)C(=O)c1oc2c(c1C)ccc(c2)NC(=O)c1ccc(c(c1)OC)OC)OC

STK621099
Synonyms: [1- (2- {[4- chloro- 2- (phenylcarbonyl)phenyl]amino}- 2- oxoethyl)cyclopentyl]aceticacid
Smiles: O=C(CC1(CCCC1)CC(=O)O)Nc1ccc(cc1C(=O)c1ccccc1)Cl

STK621100
Synonyms: (2E)- 2- [(1- ethyl- 5- methoxy- 1H- indol- 3- yl)methylidene]- 6- [(4- fluorobenzyl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OCc1ccc(cc1)F)cn2CC

STK856305
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 7- [(4- methylpiperazin- 1- ium- 1- yl)methyl]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: CN1CC[NH+](CC1)Cc1c([O-])ccc2c1O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O

STK621105
Synonyms: 4- (4- chlorophenyl)- 2- {3- methyl- 5- [4- (methylsulfanyl)phenyl]- 4,5- dihydro- 1H- pyrazol- 1- yl}- 1,3- thiazole
Smiles: CSc1ccc(cc1)C1CC(=NN1c1scc(n1)c1ccc(cc1)Cl)C

STK621107
Synonyms: tert- butyl({(2Z)- 2- [(6- bromo- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl}oxy)acetate
Smiles: O=C(OC(C)(C)C)COc1ccc2c(c1)O/C(=C\c1cc(Br)cc3c1OCOC3)/C2=O

STK621108
Synonyms: 3- [(10aS)- 7,8- dimethoxy- 1,3- dioxo- 1,5,10,10a- tetrahydroimidazo[1,5- b]isoquinolin- 2(3H)- yl]- N- (pyridin- 2- ylmethyl)propanamide
Smiles: COc1cc2CN3C(=O)N(C(=O)[C@@H]3Cc2cc1OC)CCC(=O)NCc1ccccn1

STK621111
Synonyms: N- (4- acetylphenyl)- 4- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)benzenesulfonamide
Smiles: O=C1N(c2ccc(cc2)S(=O)(=O)Nc2ccc(cc2)C(=O)C)S(=O)(=O)CC1(C)C

STK621116
Synonyms: 2- [4- ethoxy- 3- (pyrrolidin- 1- ylsulfonyl)phenyl]- 1,2- thiazolidin- 3- one1,1- dioxide
Smiles: CCOc1ccc(cc1S(=O)(=O)N1CCCC1)N1C(=O)CCS1(=O)=O

STK856306
Synonyms: 7- [(3- methoxybenzyl)oxy]- 3- (2- methoxyphenyl)- 4H- chromen- 4- one
Smiles: COc1cccc(c1)COc1ccc2c(c1)occ(c2=O)c1ccccc1OC

STK621117
Synonyms: N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 1H- indole- 3- carboxamide
Smiles: O=C(c1c[nH]c2c1cccc2)Nc1ccc2c(c1)OCCO2

STK621118
Synonyms: 4- {(5E)- 5- [(6- hydroxy[1,3]dioxolo[4,5- g]quinolin- 7- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}butanoicacid
Smiles: Oc1nc2cc3OCOc3cc2cc1/C=C\1/SC(=S)N(C1=O)CCCC(=O)O

STK621133
Synonyms: 5- amino- 1- (3- bromophenyl)- N- (thiophen- 2- ylmethyl)- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: Brc1cccc(c1)n1nnc(c1N)C(=O)NCc1cccs1

STK621134
Synonyms: N- [(4- hydroxyphthalazin- 1- yl)acetyl]glutamicacid
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NC(C(=O)O)CCC(=O)O

STK621135
Synonyms: 4- (2,1,3- benzoxadiazol- 4- yl)- 5- (2,5- difluorophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Fc1ccc(c(c1)c1n[nH]c(=S)n1c1cccc2c1non2)F

STK621137
Synonyms: [4- (3- chlorophenyl)piperazin- 1- yl][1- (piperidin- 1- ylmethyl)- 1H- indol- 3- yl]methanone
Smiles: Clc1cccc(c1)N1CCN(CC1)C(=O)c1cn(c2c1cccc2)CN1CCCCC1

STK621138
Synonyms: 4- oxo- 4- {[2- (piperidin- 1- ylsulfonyl)ethyl](pyridin- 2- ylmethyl)amino}butanoicacid
Smiles: OC(=O)CCC(=O)N(Cc1ccccn1)CCS(=O)(=O)N1CCCCC1

STK621139
Synonyms: N- [(1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- yl)methyl]- 2- (4- hydroxyphthalazin- 1- yl)acetamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)NCc1cc(=O)n(c(=O)n1C)C

STK621142
Synonyms: N- (4- hydroxy- 6- methylpyrimidin- 2- yl)morpholine- 4- carboximidamide
Smiles: Cc1nc(nc(c1)O)NC(=N)N1CCOCC1

STK621143
Synonyms: methyl(2E)- 3- (2,4- dihydroxy- 6- methylpyrimidin- 5- yl)prop- 2- enoate
Smiles: COC(=O)/C=C/c1c(C)nc(nc1O)O

STK621145
Synonyms: 2- {[(4,6- dimethylpyrimidin- 2- yl)sulfanyl]methyl}- 1- ethyl- 1H- benzimidazol- 5- amine
Smiles: CCn1c(CSc2nc(C)cc(n2)C)nc2c1ccc(c2)N

STK621146
Synonyms: 1- cyclopentyl- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)C1CCCC1

STK621147
Synonyms: N- [2- hydroxy- 4- oxo- 3- (2- phenylethyl)- 3,4- dihydrobenzo[g]pteridin- 8- yl]acetamide
Smiles: CC(=O)Nc1ccc2c(c1)nc1c(n2)c(=O)n(c(n1)O)CCc1ccccc1

STK621148
Synonyms: 5- bromo- N- [2- (morpholin- 4- yl)ethyl]- 1- benzofuran- 2- carboxamide
Smiles: Brc1ccc2c(c1)cc(o2)C(=O)NCCN1CCOCC1

STK621152
Synonyms: 2- (pyridin- 4- yl)- 8H- pyrazolo[4,3- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: n1ccc(cc1)c1nn2c(n1)c1c[nH]nc1nc2

STK621153
Synonyms: N- cyclopropyl- Nalpha- {[4- (1H- indol- 3- ylcarbonyl)piperazin- 1- yl]carbonyl}- L- phenylalaninamide
Smiles: O=C(N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2)N[C@H](C(=O)NC1CC1)Cc1ccccc1

STK621160
Synonyms: (E)- (4- methoxy- 2- methylphenyl)[1- (3- methoxypropyl)- 4,5- dioxo- 2- (pyridinium- 3- yl)pyrrolidin- 3- ylidene]methanolate
Smiles: COCCCN1C(=O)C(=O)/C(=C(\c2ccc(cc2C)OC)/[O-])/C1c1ccc[nH+]c1

STK621161
Synonyms: 2- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)- N- methyl- N- (1- methylpiperidin- 4- yl)acetamide
Smiles: CN1CCC(CC1)N(C(=O)Cc1nn2c(n1)nc(cc2O)C)C

STK621162
Synonyms: [7- (3- hydroxyphenyl)- 5- methyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl](piperidin- 1- yl)methanone
Smiles: Oc1cccc(c1)C1C(=C(C)N=c2n1nc[nH]2)C(=O)N1CCCCC1

STK621165
Synonyms: 2- (3- hydroxy- 1,2- dihydroquinoxalin- 2- yl)- N- [4- (trifluoromethoxy)phenyl]acetamide
Smiles: O=C(CC1Nc2ccccc2N=C1O)Nc1ccc(cc1)OC(F)(F)F

STK621166
Synonyms: N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- (pyridin- 3- ylmethyl)glycinamide
Smiles: O=C(NCc1cccnc1)CNC(=O)Cc1nnc(c2c1cccc2)O

STK621169
Synonyms: 2- ({[3- methyl- 4- (2,2,2- trifluoroethoxy)pyridin- 2- yl]methyl}sulfinyl)- 1H- benzimidazole
Smiles: O=S(c1nc2c([nH]1)cccc2)Cc1nccc(c1C)OCC(F)(F)F

STK621172
Synonyms: 1- [4- (1,2- benzothiazol- 3- yl)piperazin- 1- yl]- 2- (4- methoxyphenoxy)ethanone
Smiles: COc1ccc(cc1)OCC(=O)N1CCN(CC1)c1nsc2c1cccc2

STK621174
Synonyms: 5- methyl- 3- (3- phenyl- 1,2,4- oxadiazol- 5- yl)- 4,5,6,7- tetrahydro- 2H- indazole
Smiles: CC1CCc2c(C1)c([nH]n2)c1onc(n1)c1ccccc1

STK621180
Synonyms: 1- (3,4- difluorophenyl)- 4- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 1H- pyrazolo[3,4- d]pyrimidine
Smiles: Cc1nn(c(c1)C)c1ncnc2c1cnn2c1ccc(c(c1)F)F

STK621182
Synonyms: (2E)- 7- methyl- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylthiophene- 2- carboxylate
Smiles: O=C1/C(=C\c2cn(c3c2cccc3)C)/Oc2c1ccc(c2C)OC(=O)c1cccs1

STK621183
Synonyms: 8,9- dimethyl- 2- (phenoxymethyl)- 7- (pyridin- 4- ylmethyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1n(Cc2ccncc2)c2c(c1C)c1nc(nn1cn2)COc1ccccc1

STK621184
Synonyms: 1- (4- methoxyphenyl)- 3- methyl- 4- (thiophen- 3- yl)- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: COc1ccc(cc1)n1nc(c2c1N=C(O)CC2c1cscc1)C

STK621185
Synonyms: (2Z)- 2- (1,3- benzodioxol- 5- ylmethylidene)- 6- [(4- methylbenzyl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: Cc1ccc(cc1)COc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/C2=O

STK856310
Synonyms: (5Z)- 5- [5- (1,3- benzodioxol- 5- yl)pyrazolidin- 3- ylidene]- 1- methyl- 2- sulfanylpyrimidine- 4,6(1H,5H)- dione
Smiles: CN1C(=NC(=O)/C(=C\2/NNC(C2)c2ccc3c(c2)OCO3)/C1=O)S

STK621186
Synonyms: 6- [2- (3,4- dimethoxyphenyl)ethyl]- 3- (thiophen- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1cc(CCc2nn3c(s2)nnc3c2cccs2)ccc1OC

STK621187
Synonyms: 1- [3- (4- hydroxy- 1,7- dimethyl- 2- oxo- 1,2- dihydro- 8H- imidazo[2,1- f]purin- 8- yl)propyl]piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)CCCn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK621188
Synonyms: 6- {[4- (tert- butylamino)- 6- (methylsulfanyl)- 1,3,5- triazin- 2- yl]oxy}- 2- phenylpyridazin- 3(2H)- one
Smiles: CSc1nc(nc(n1)NC(C)(C)C)Oc1ccc(=O)n(n1)c1ccccc1

STK621193
Synonyms: 8- methoxy- 6- [4- methoxy- 3- (morpholin- 4- ylmethyl)phenyl]- 1,3- dimethyl- 4H- cyclohepta[c]furan- 4- one
Smiles: COc1ccc(cc1CN1CCOCC1)c1cc(=O)c2c(c(c1)OC)c(oc2C)C

STK621194
Synonyms: N- butyl- 2- (6- ethyl- 5- methyl- 4- oxothieno[2,3- d][1,2,3]triazin- 3(4H)- yl)- N- methylacetamide
Smiles: CCCCN(C(=O)Cn1nnc2c(c1=O)c(C)c(s2)CC)C

STK621196
Synonyms: N- (3- cyano- 4,5- dimethylfuran- 2- yl)- 2- (2- methoxyphenoxy)acetamide
Smiles: COc1ccccc1OCC(=O)Nc1oc(c(c1C#N)C)C

STK621200
Synonyms: 7- (pyridin- 2- yl)thieno[2,3- b:4,5- b']dipyridine- 2,4- diol
Smiles: Oc1cc(O)c2c(n1)c1ccc(nc1s2)c1ccccn1

STK621202
Synonyms: 4- [2- (4- methylpiperazin- 1- yl)- 2- oxoethyl]- N- phenylpiperazine- 1- carbothioamide
Smiles: CN1CCN(CC1)C(=O)CN1CCN(CC1)C(=S)Nc1ccccc1

STK856312
Synonyms: (2Z)- 2- benzylidene- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylbenzenesulfonate
Smiles: O=C1/C(=C/c2ccccc2)/Oc2c1ccc(c2)OS(=O)(=O)c1ccccc1

STK621206
Synonyms: 1- (3,4- difluorophenyl)- 4- (morpholin- 4- yl)- 1H- pyrazolo[3,4- d]pyrimidine
Smiles: Fc1ccc(cc1F)n1ncc2c1ncnc2N1CCOCC1

STK621209
Synonyms: 10'- butyl- 4- tert- butyl- 5'- methyl- 8'H- spiro[cyclohexane- 1,2'- pyrano[2,3- f]chromene]- 4',8'(3'H)- dione
Smiles: CCCCc1cc(=O)oc2c1c1OC3(CCC(CC3)C(C)(C)C)CC(=O)c1c(c2)C

STK621212
Synonyms: N- [2- (1- benzylpiperidin- 4- yl)ethyl]- 2- (3,4- dimethoxyphenyl)- 4- methyl- 1,3- thiazole- 5- carboxamide
Smiles: COc1cc(ccc1OC)c1nc(c(s1)C(=O)NCCC1CCN(CC1)Cc1ccccc1)C

STK621213
Synonyms: ethyl2- (4- ethylpiperazin- 1- yl)- 4- hydroxypyrimidine- 5- carboxylate
Smiles: CCOC(=O)c1cnc(nc1O)N1CCN(CC1)CC

STK621217
Synonyms: N- {2- [(pyridin- 2- ylmethyl)carbamoyl]phenyl}- N'- [(1,3,5- trimethyl- 1H- pyrazol- 4- yl)methyl]ethanediamide
Smiles: O=C(C(=O)NCc1c(C)nn(c1C)C)Nc1ccccc1C(=O)NCc1ccccn1

STK621220
Synonyms: ethyl4- (3- cyano- 4,6- dimethyl- 2- oxopyridin- 1(2H)- yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)n1c(C)cc(c(c1=O)C#N)C

STK621221
Synonyms: 5- [3- (1,3- benzodioxol- 5- yl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]- 2- chlorobenzoicacid
Smiles: OC(=O)c1cc(ccc1Cl)n1c(=S)[nH]nc1c1ccc2c(c1)OCO2

STK621222
Synonyms: N- {(5Z)- 5- [(1- methyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}pyridine- 4- carboxamide
Smiles: S=C1S/C(=C\c2ccc3c(c2)CCCN3C)/C(=O)N1NC(=O)c1ccncc1

STK621224
Synonyms: (2Z)- 2- (furan- 2- ylmethylidene)- 8- (4- methylphenyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: Cc1ccc(cc1)N1COc2c(C1)c1O/C(=C\c3ccco3)/C(=O)c1cc2

STK856315
Synonyms: 2- {[6- tert- butyl- 3- cyano- 4- (trifluoromethyl)- 5,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)N)nc2c(c1C(F)(F)F)CC(CC2)C(C)(C)C

STK621237
Synonyms: methyl2- ({[(2- methoxybenzyl)amino](oxo)acetyl}amino)- 4,5- dimethylthiophene- 3- carboxylate
Smiles: COc1ccccc1CNC(=O)C(=O)Nc1sc(c(c1C(=O)OC)C)C

STK856316
Synonyms: 5- amino- N- (3- chloro- 4- methoxyphenyl)- 1- phenyl- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: COc1ccc(cc1Cl)NC(=O)c1nnn(c1N)c1ccccc1

STK621239
Synonyms: 1- (1H- indol- 3- ylacetyl)- N- [2- (thiophen- 2- yl)ethyl]piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)Cc1c[nH]c2c1cccc2)NCCc1cccs1

STK621242
Synonyms: 2- chloro- 5- [3- (2- hydroxyphenyl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]benzoicacid
Smiles: Oc1ccccc1c1n[nH]c(=S)n1c1ccc(c(c1)C(=O)O)Cl

STK621243
Synonyms: 4- (4- bromobenzyl)- 2- (2- methoxyphenyl)- 5- methyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccccc1n1[nH]c(c(c1=O)Cc1ccc(cc1)Br)C

STK621251
Synonyms: 2- phenyl- 5- {[(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]methyl}- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: O=c1cc([nH]n1c1ccccc1)CSc1nnnn1c1ccccc1

STK856317
Synonyms: N- {2- [1- acetyl- 5- (quinoxalin- 6- yl)- 4,5- dihydro- 1H- pyrazol- 3- yl]phenyl}methanesulfonamide
Smiles: CC(=O)N1N=C(CC1c1ccc2c(c1)nccn2)c1ccccc1NS(=O)(=O)C

STK621252
Synonyms: 6- [(E)- 2- phenylethenyl]- 3- (pyrazin- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: c1ccc(cc1)/C=C/c1nn2c(s1)nnc2c1cnccn1

STK621255
Synonyms: N~6~- (2- methoxyphenyl)- 7H- purine- 2,6- diamine
Smiles: COc1ccccc1Nc1nc(N)nc2c1[nH]cn2

STK621257
Synonyms: (2Z)- 8- (tetrahydrofuran- 2- ylmethyl)- 2- (3,4,5- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(/C=C/2\Oc3c(C2=O)ccc2c3CN(CO2)CC2CCCO2)cc(c1OC)OC

STK621264
Synonyms: N- (3,5- dimethoxyphenyl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: COc1cc(cc(c1)OC)NC(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK621268
Synonyms: N- methyl- 4- (morpholin- 4- yl)- 6- {3- [(2- phenoxyethyl)sulfanyl]- 1H- 1,2,4- triazol- 1- yl}- 1,3,5- triazin- 2- amine
Smiles: CNc1nc(nc(n1)N1CCOCC1)n1cnc(n1)SCCOc1ccccc1

STK621269
Synonyms: N- [2- hydroxy- 1- (2- methoxyphenyl)- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]- 2- phenylacetamide
Smiles: COc1ccccc1N1C(=NC(C1=O)(NC(=O)Cc1ccccc1)C(F)(F)F)O

STK621271
Synonyms: [1- (9H- purin- 6- yl)piperidin- 4- yl]{4- [2- (pyridin- 2- yl)ethyl]piperazin- 1- yl}methanone
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)N1CCN(CC1)CCc1ccccn1

STK621274
Synonyms: 2- {[3- (3,4- dihydro- 2H- 1,5- benzodioxepin- 7- yl)- 6- ethyl- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: CCc1cc2c(cc1OCC(=O)N)oc(c(c2=O)c1ccc2c(c1)OCCCO2)C

STK621275
Synonyms: (2E)- 6- [(2- chlorobenzyl)oxy]- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 1- benzofuran- 3(2H)- one
Smiles: O=C1/C(=C\c2cn(c3c2cccc3)C)/Oc2c1ccc(c2)OCc1ccccc1Cl

STK621276
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- N- [3- (1H- imidazol- 1- yl)propyl]- 2- (thiophen- 2- yl)- 1,3- oxazol- 5- amine
Smiles: O=S(=O)(c1nc(oc1NCCCn1ccnc1)c1cccs1)c1ccc2c(c1)OCCO2

STK621278
Synonyms: 2- (2- methoxyphenyl)- 5- (3- methoxyphenyl)- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1cccc(c1)c1[nH]n(c(=O)c1)c1ccccc1OC

STK856318
Synonyms: 1- (2,1,3- benzothiadiazol- 4- ylsulfonyl)- N- (1,3- thiazol- 2- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)S(=O)(=O)c1cccc2c1nsn2)Nc1nccs1

STK856319
Synonyms: 3- (4- methoxyphenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- ylacetate
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OC(=O)C

STK621281
Synonyms: 4- (1H- indol- 2- ylcarbonyl)- N- [(2S)- 3- methyl- 1- oxo- 1- (1,3- thiazol- 2- ylamino)butan- 2- yl]piperazine- 1- carboxamide
Smiles: CC([C@@H](C(=O)Nc1nccs1)NC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2)C

STK621282
Synonyms: N- {(2S)- 1- [(3- fluorophenyl)amino]- 1- oxopropan- 2- yl}- 4- (1H- indol- 2- ylcarbonyl)piperazine- 1- carboxamide
Smiles: Fc1cccc(c1)NC(=O)[C@@H](NC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2)C

STK621287
Synonyms: 5- imino- 4- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]- 1- [3- (morpholin- 4- yl)propyl]- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: COc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)CCCN1CCOCC1

STK621288
Synonyms: (2Z)- 8- (furan- 2- ylmethyl)- 2- [(5- methylfuran- 2- yl)methylidene]- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: Cc1ccc(o1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccco1

STK621289
Synonyms: 2- methyl- 3- phenyl- 9- (pyridin- 3- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: Cc1oc2c3CN(COc3ccc2c(=O)c1c1ccccc1)Cc1cccnc1

STK621292
Synonyms: 2- (2- methoxy- 2- oxoethyl)- 1,1- dioxido- 2H- 1,2- benzothiazin- 4- yl2- methylpropanoate
Smiles: COC(=O)CN1C=C(OC(=O)C(C)C)c2c(S1(=O)=O)cccc2

STK621293
Synonyms: 6- (3- bromo- 4- fluorophenyl)- 3- (3,4- dimethoxyphenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1cc(ccc1OC)c1nnc2n1nc(s2)c1ccc(c(c1)Br)F

STK621295
Synonyms: 3- (3,4- dimethoxyphenyl)- 7- [2- (4- methylpiperazin- 1- yl)- 2- oxoethoxy]- 2H- chromen- 2- one
Smiles: COc1cc(ccc1OC)c1cc2ccc(cc2oc1=O)OCC(=O)N1CCN(CC1)C

STK621297
Synonyms: 7- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- ylcarbonyl)- 5- ethyl[1,3]dioxolo[4,5- g]quinolin- 8(5H)- one
Smiles: CCn1cc(C(=O)N2CCC3(CC2)OCCO3)c(=O)c2c1cc1OCOc1c2

STK621300
Synonyms: N- acetyl- S- [6- (dimethylamino)- 2- methylquinolin- 4- yl]cysteine
Smiles: CC(=O)NC(C(=O)O)CSc1cc(C)nc2c1cc(cc2)N(C)C

STK621302
Synonyms: 2- chloro- 6- (4- phenylpiperazin- 1- yl)- 7H- purine
Smiles: Clc1nc2nc[nH]c2c(n1)N1CCN(CC1)c1ccccc1

STK621304
Synonyms: 9- (2- fluorophenyl)- 2- methyl- 3- phenyl- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: Fc1ccccc1N1COc2c(C1)c1oc(C)c(c(=O)c1cc2)c1ccccc1

STK621306
Synonyms: N- [2- hydroxy- 5- oxo- 1- (pyridin- 3- ylmethyl)- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]- 3- methylbutanamide
Smiles: CC(CC(=O)NC1(N=C(N(C1=O)Cc1cccnc1)O)C(F)(F)F)C

STK621308
Synonyms: 4- hydroxy- 3,6,6- trimethyl- N- (1- phenylethyl)- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O=C(c1oc2c(c1C)C(O)CC(C2)(C)C)NC(c1ccccc1)C

STK621310
Synonyms: N- (3- chloro- 4- fluorophenyl)- 7- methoxy- 6- [3- (morpholin- 4- yl)propoxy]quinazolin- 4- amine
Smiles: COc1cc2ncnc(c2cc1OCCCN1CCOCC1)Nc1ccc(c(c1)Cl)F

STK621312
Synonyms: 3- [(pyridin- 2- ylmethyl)sulfanyl]- 9H- [1,2,4]triazolo[4,3- a]benzimidazole
Smiles: c1ccc(nc1)CSc1nnc2n1c1ccccc1[nH]2

STK621314
Synonyms: 5- (1,3- benzodioxol- 5- yl)- 2- hydroxypyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Oc1nc(=O)c2c([nH]1)nccc2c1ccc2c(c1)OCO2

STK621315
Synonyms: 3- [(2,4- dichlorophenoxy)methyl]- 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2COc1ccc(cc1Cl)Cl)C

STK621317
Synonyms: N- {4- [4- hydroxy- 2- imino- 3- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 1- yl]phenyl}acetamide
Smiles: CC(=O)Nc1ccc(cc1)N1CC(=C(C1=N)c1scc(n1)C)O

STK621322
Synonyms: 8- chloro- 5,7- difluoro- 4- (pyridin- 3- ylmethyl)- 3,4- dihydro- 2H- pyrido[4,3- b][1,4]thiazine1,1- dioxide
Smiles: Fc1nc(F)c(c2c1N(CCS2(=O)=O)Cc1cccnc1)Cl

STK621326
Synonyms: (3- {(Z)- [1- (3,5- dimethylphenyl)- 4- hydroxy- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene]methyl}- 1H- indol- 1- yl)aceticacid
Smiles: OC(=O)Cn1cc(c2c1cccc2)/C=C\1/C(=NC(=O)N(C1=O)c1cc(C)cc(c1)C)O

STK621328
Synonyms: propan- 2- yl(2Z)- 2- [(1,3- benzodioxol- 5- ylcarbonyl)imino]- 2,3- dihydro- 1,3- benzothiazole- 6- carboxylate
Smiles: CC(OC(=O)c1ccc2c(c1)s/c(=N\C(=O)c1ccc3c(c1)OCO3)/[nH]2)C

STK621329
Synonyms: 3,4,8,8- tetramethyl- 5- {2- oxo- 2- [4- (pyrimidin- 2- yl)piperazin- 1- yl]ethoxy}- 9,10- dihydro- 2H,8H- pyrano[2,3- f]chromen- 2- one
Smiles: O=C(N1CCN(CC1)c1ncccn1)COc1cc2OC(C)(C)CCc2c2c1c(C)c(c(=O)o2)C

STK621330
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl3- methoxybenzoate
Smiles: COc1cccc(c1)C(=O)Oc1ccc2c(c1C)O/C(=C/c1cn(c3c1cc(OC)cc3)C)/C2=O

STK621331
Synonyms: 2- [(methylamino)methyl]thieno[3,2- d]pyrimidin- 4- ol
Smiles: CNCc1nc(O)c2c(n1)ccs2

STK621332
Synonyms: 4- [4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (2- methoxyphenyl)- 1,3- oxazol- 5- yl]morpholine
Smiles: COc1ccccc1c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)N1CCOCC1

STK621334
Synonyms: N- (2- fluorophenyl)- 2- {[3- (2- methoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: COc1ccccc1Oc1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1ccccc1F

STK621335
Synonyms: (2- bromophenyl)[1- (3,4- diethoxybenzyl)- 6,7- diethoxy- 3,4- dihydroisoquinolin- 2(1H)- yl]methanone
Smiles: CCOc1cc(ccc1OCC)CC1c2cc(OCC)c(cc2CCN1C(=O)c1ccccc1Br)OCC

STK621338
Synonyms: 3- {(5E)- 5- [(7- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}benzoicacid
Smiles: COc1ccc2c(c1)[nH]c(=O)c(c2)/C=C\1/SC(=S)N(C1=O)c1cccc(c1)C(=O)O

STK621340
Synonyms: [(2S)- 2- (hydroxymethyl)pyrrolidin- 1- yl][2- (1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl]methanone
Smiles: OC[C@@H]1CCCN1C(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK621343
Synonyms: 3- (4- fluorophenyl)- 5- methyl- N- [2- (morpholin- 4- yl)ethyl]pyrazolo[1,5- a]pyrimidin- 7- amine
Smiles: Cc1cc(NCCN2CCOCC2)n2c(n1)c(cn2)c1ccc(cc1)F

STK621344
Synonyms: (2Z)- 3- oxo- 2- [4- (propan- 2- yl)benzylidene]- 2,3- dihydro- 1- benzofuran- 6- yl2,2- dimethylpropanoate
Smiles: O=C(C(C)(C)C)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(C)C)/C2=O

STK621345
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 2- (4,6- dimethyl- 2- oxopyrimidin- 1(2H)- yl)acetamide
Smiles: O=C(Cn1c(C)cc(nc1=O)C)NCCc1c[nH]c2c1cc(Cl)cc2

STK621347
Synonyms: 2,2'- [(5- chloro- 3,6- difluoropyridine- 2,4- diyl)disulfanediyl]diethanol
Smiles: OCCSc1nc(F)c(c(c1F)SCCO)Cl

STK621349
Synonyms: 2- (7,8- dimethoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- (morpholin- 4- yl)acetamide
Smiles: COc1c(OC)ccc2c1oc(=O)c(c2C)CC(=O)NN1CCOCC1

STK621351
Synonyms: 3- {(5E)- 5- [(6- methoxyquinolin- 2- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}benzoicacid
Smiles: COc1ccc2c(c1)ccc(n2)/C=C\1/SC(=S)N(C1=O)c1cccc(c1)C(=O)O

STK621352
Synonyms: [(2Z)- 2- {[(5- methoxy- 4,7- dimethyl- 2- oxo- 2H- chromen- 3- yl)acetyl]imino}- 2,3- dihydro- 1,3- thiazol- 4- yl]aceticacid
Smiles: COc1cc(C)cc2c1c(C)c(c(=O)o2)CC(=O)/N=c/1\scc([nH]1)CC(=O)O

STK621354
Synonyms: 2- [(4- oxo- 3,4- dihydrospiro[chromene- 2,1'- cyclohexan]- 7- yl)oxy]- N- (pyridin- 4- ylmethyl)acetamide
Smiles: O=C(NCc1ccncc1)COc1ccc2c(c1)OC1(CC2=O)CCCCC1

STK621357
Synonyms: 3- (3,4- dihydroquinolin- 1(2H)- yl)- 6- methyl- 1,2,4- triazin- 5- ol
Smiles: Cc1nnc(nc1O)N1CCCc2c1cccc2

STK621358
Synonyms: N- (1H- tetrazol- 5- yl)- 2- (4,8,8- trimethyl- 2- oxo- 7,8- dihydro- 2H,6H- pyrano[3,2- g]chromen- 3- yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)OC(CC1)(C)C)Nc1nnn[nH]1

STK621360
Synonyms: (2Z)- 2- (1,3- benzodioxol- 5- ylmethylidene)- 6- [(4- methoxybenzyl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: COc1ccc(cc1)COc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/C2=O

STK621361
Synonyms: 2- [(6- chloro- 4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- [2- (dimethylamino)ethyl]acetamide
Smiles: CN(CCNC(=O)COc1cc2oc(=O)cc(c2cc1Cl)C)C

STK621364
Synonyms: N- (4- chloro- 1,1- dioxidotetrahydrothiophen- 3- yl)propanamide
Smiles: CCC(=O)NC1CS(=O)(=O)CC1Cl

STK621366
Synonyms: 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (2,4- dimethoxyphenyl)propanamide
Smiles: COc1cc(OC)ccc1NC(=O)CCSc1nc(Cl)nc2c1[nH]cn2

STK621369
Synonyms: ethyl2- (4- ethylpiperazin- 1- yl)- 6- oxo- 4- (thiophen- 2- yl)- 1,4,5,6- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=NC1c1cccs1)N1CCN(CC1)CC

STK621370
Synonyms: 2- {1- [3- (3- nitrophenoxy)propyl]piperidin- 4- yl}- 1,3- benzothiazole
Smiles: [O-][N+](=O)c1cccc(c1)OCCCN1CCC(CC1)c1nc2c(s1)cccc2

STK856322
Synonyms: N- (furan- 2- ylmethyl)- 6- oxo- 1- phenyl- 1,4,5,6- tetrahydropyridazine- 3- carboxamide
Smiles: O=C1CCC(=NN1c1ccccc1)C(=O)NCc1ccco1

STK621372
Synonyms: 7- {2- [4- (2- hydroxyethyl)piperazin- 1- yl]- 2- oxoethoxy}- 3- phenyl- 4H- chromen- 4- one
Smiles: OCCN1CCN(CC1)C(=O)COc1ccc2c(c1)occ(c2=O)c1ccccc1

STK621373
Synonyms: [4- (1,2- benzothiazol- 3- yl)piperazin- 1- yl](4- bromophenyl)methanethione
Smiles: Brc1ccc(cc1)C(=S)N1CCN(CC1)c1nsc2c1cccc2

STK621377
Synonyms: methylN- {[4- (1,3- benzothiazol- 2- yl)piperidin- 1- yl]carbonyl}glycinate
Smiles: COC(=O)CNC(=O)N1CCC(CC1)c1nc2c(s1)cccc2

STK621379
Synonyms: 1- (4- acetylphenyl)- 3- (6- bromo- 1,3,4,5- tetrahydro- 2H- pyrido[4,3- b]indol- 2- yl)pyrrolidine- 2,5- dione
Smiles: O=C1CC(C(=O)N1c1ccc(cc1)C(=O)C)N1CCc2c(C1)c1cccc(c1[nH]2)Br

STK621380
Synonyms: N- (2,5- dichlorophenyl)- 1- (9H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)Nc1cc(Cl)ccc1Cl

STK621386
Synonyms: 2- chloro- 5- [3- (2,4- dihydroxyphenyl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]benzoicacid
Smiles: Oc1ccc(c(c1)O)c1n[nH]c(=S)n1c1ccc(c(c1)C(=O)O)Cl

STK621388
Synonyms: 1- (4,6- dimethylpyrimidin- 2- yl)- 4- (3- hydroxy- 4- methoxyphenyl)- 3- methyl- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: COc1ccc(cc1O)C1CC(=Nc2c1c(C)nn2c1nc(C)cc(n1)C)O

STK621389
Synonyms: 4- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]- 5- imino- 1- (2,2,6,6- tetramethylpiperidin- 4- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: COc1cc(ccc1OC)c1csc(n1)C1=C(O)CN(C1=N)C1CC(C)(C)NC(C1)(C)C

STK621390
Synonyms: (3R)- N- (4- hydroxyphenyl)- 5- oxo- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: Oc1ccc(cc1)NC(=O)[C@@H]1CSC2N1C(=O)c1c2cccc1

STK621394
Synonyms: 1- [2- (dimethylamino)- 1- (4- methoxyphenyl)ethyl]cyclohexanol
Smiles: COc1ccc(cc1)C(C1(O)CCCCC1)CN(C)C

STK621395
Synonyms: N- pyridin- 3- yl- N~3~- pyrimidin- 2- yl- beta- alaninamide
Smiles: O=C(Nc1cccnc1)CCNc1ncccn1

STK621397
Synonyms: N- (2,1,3- benzoxadiazol- 4- yl)- 3- [(5Z)- 5- (3- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]propanamide
Smiles: O=C(Nc1cccc2c1non2)CCN1C(=S)S/C(=C\c2cccc(c2)F)/C1=O

STK621398
Synonyms: (2Z)- 8- (3,4- dimethoxybenzyl)- 2- (furan- 2- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(ccc1OC)CN1COc2c(C1)c1O/C(=C\c3ccco3)/C(=O)c1cc2

STK621403
Synonyms: 2- [(4- methoxyphenoxy)methyl]- 7- (3- methoxyphenyl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1ccc(cc1)OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)c1cccc(c1)OC

STK621404
Synonyms: methyl(9- methoxy- 2,3- dimethyl- 6H- indolo[2,3- b]quinoxalin- 6- yl)acetate
Smiles: COC(=O)Cn1c2nc3cc(C)c(cc3nc2c2c1ccc(c2)OC)C

STK621406
Synonyms: 2- [3- (2- methylfuran- 3- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]quinoline
Smiles: Cc1occc1c1nnc2n1nc(s2)c1ccc2c(n1)cccc2

STK856323
Synonyms: 5- (furan- 2- yl)- 7- (trifluoromethyl)pyrazolo[1,5- a]pyrimidine- 3- carbonitrile
Smiles: N#Cc1cnn2c1nc(cc2C(F)(F)F)c1ccco1

STK621410
Synonyms: 2- {3- [(4- chlorophenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl}- 1H- indole
Smiles: Clc1ccc(cc1)OCc1nnc2n1nc(s2)c1cc2c([nH]1)cccc2

STK621411
Synonyms: ethyl4- hydroxy- 2- [(2- methoxyphenyl)amino]pyrimidine- 5- carboxylate
Smiles: CCOC(=O)c1cnc(nc1O)Nc1ccccc1OC

STK621414
Synonyms: N- [2- (2,3- dihydro- 1H- inden- 2- ylcarbamoyl)phenyl]- N'- (3- hydroxypropyl)ethanediamide
Smiles: OCCCNC(=O)C(=O)Nc1ccccc1C(=O)NC1Cc2c(C1)cccc2

STK621416
Synonyms: (2E)- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methylbenzenesulfonate
Smiles: Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK621419
Synonyms: (4E)- 4- {[5- (4- chlorophenyl)- 1H- pyrazol- 4- yl]methylidene}- 1- phenylpyrazolidine- 3,5- dione
Smiles: Clc1ccc(cc1)c1[nH]ncc1/C=C/1\C(=O)NN(C1=O)c1ccccc1

STK621420
Synonyms: (2R,3R)- 1- benzyl- 2- [4- (methylsulfanyl)phenyl]- 5- oxopyrrolidine- 3- carboxylicacid
Smiles: CSc1ccc(cc1)[C@H]1[C@@H](CC(=O)N1Cc1ccccc1)C(=O)O

STK621421
Synonyms: N- (5- bromo- 1- ethyl- 2- oxo- 2,3- dihydro- 1H- indol- 3- yl)- N'- [2- (1H- indol- 3- yl)ethyl]ethanediamide
Smiles: CCN1C(=O)C(c2c1ccc(c2)Br)NC(=O)C(=O)NCCc1c[nH]c2c1cccc2

STK621422
Synonyms: 8- {[2- (dimethylamino)ethyl]amino}- 6- [(4- methoxyphenyl)amino]- 3,3- dimethyl- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(Nc2ccc(cc2)OC)nc(c2c1CC(C)(C)OC2)NCCN(C)C

STK621424
Synonyms: N- [(1R)- 2- (1,4- dioxa- 8- azaspiro[4.5]dec- 8- yl)- 2- oxo- 1- phenylethyl]- 2,2- diphenylacetamide
Smiles: O=C([C@@H](c1ccccc1)NC(=O)C(c1ccccc1)c1ccccc1)N1CCC2(CC1)OCCO2

STK621427
Synonyms: (2E)- 2- [(1- ethyl- 5- methoxy- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylcyclohexanecarboxylate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OC(=O)C1CCCCC1)cn2CC

STK621429
Synonyms: 2- [(5- hydroxy- 2,2- dimethyl- 4- oxo- 3,4- dihydro- 2H- chromen- 7- yl)oxy]- N- (6- methylpyridin- 2- yl)acetamide
Smiles: O=C(Nc1cccc(n1)C)COc1cc(O)c2c(c1)OC(CC2=O)(C)C

STK621430
Synonyms: trans- 4- [({[4- (acetylamino)phenyl]sulfonyl}amino)methyl]- N- (3- hydroxyphenyl)cyclohexanecarboxamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)Nc1cccc(c1)O

STK621432
Synonyms: 3- (dimethylamino)- N- [(2E)- 6- (morpholin- 4- ylsulfonyl)- 1,3- benzothiazol- 2(3H)- ylidene]benzamide
Smiles: O=C(c1cccc(c1)N(C)C)/N=c\1/sc2c([nH]1)ccc(c2)S(=O)(=O)N1CCOCC1

STK621434
Synonyms: 3- (4- methoxyphenyl)- 2- methyl- 5- {[(5- methyl- 1,3,4- thiadiazol- 2- yl)sulfanyl]methyl}pyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: COc1ccc(cc1)c1c(C)nn2c1nc(CSc1nnc(s1)C)cc2O

STK621435
Synonyms: N- [2- (4- hydroxyphenyl)ethyl]- 6- oxo- 1- phenyl- 1,4,5,6- tetrahydropyridazine- 3- carboxamide
Smiles: Oc1ccc(cc1)CCNC(=O)C1=NN(C(=O)CC1)c1ccccc1

STK621444
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- [(5Z)- 5- (3- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- methylpropanamide
Smiles: Fc1cccc(c1)/C=C/1\SC(=S)N(C1=O)C(C(=O)N(C1CCS(=O)(=O)C1)C)C

STK621446
Synonyms: 3- {2- [4- (4- chlorophenyl)- 4- hydroxypiperidin- 1- yl]- 2- oxoethyl}- 7- methoxy- 4- methyl- 2H- chromen- 2- one
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)N1CCC(CC1)(O)c1ccc(cc1)Cl

STK621448
Synonyms: 4- (1H- indol- 3- ylcarbonyl)- N- [3- oxo- 3- (1,3- thiazol- 2- ylamino)propyl]piperazine- 1- carboxamide
Smiles: O=C(Nc1nccs1)CCNC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2

STK621449
Synonyms: 2- [3- (pyridin- 3- yl)- 1,2,4- oxadiazol- 5- yl]pyrazine
Smiles: c1ccc(cn1)c1noc(n1)c1cnccn1

STK621451
Synonyms: 6- chloro- 4- methyl- 7- [(2- methylprop- 2- en- 1- yl)oxy]- 3- (2- oxo- 2- {4- [2- (pyridin- 4- yl)ethyl]piperazin- 1- yl}ethyl)- 2H- chromen- 2- one
Smiles: O=C(N1CCN(CC1)CCc1ccncc1)Cc1c(=O)oc2c(c1C)cc(c(c2)OCC(=C)C)Cl

STK621453
Synonyms: 1- (9H- carbazol- 4- yloxy)- 3- {[2- (2- methoxyphenoxy)ethyl]amino}propan- 2- ol
Smiles: COc1ccccc1OCCNCC(COc1cccc2c1c1ccccc1[nH]2)O

STK621454
Synonyms: 1- (1H- indol- 6- ylcarbonyl)- N- (5- methyl- 1,3- thiazol- 2- yl)piperidine- 3- carboxamide
Smiles: Cc1cnc(s1)NC(=O)C1CCCN(C1)C(=O)c1ccc2c(c1)[nH]cc2

STK621455
Synonyms: 2- {[5,6- dimethyl- 7- (pyridin- 2- ylmethyl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl]amino}ethanol
Smiles: OCCNc1ncnc2c1c(C)c(n2Cc1ccccn1)C

STK621456
Synonyms: 5- imino- 1- (2- phenylethyl)- 4- (4- phenyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2scc(n2)c2ccccc2)C(=N)N(C1)CCc1ccccc1

STK621457
Synonyms: N- [(2Z)- 6- {[2- (hydroxymethyl)pyrrolidin- 1- yl]carbonyl}- 1,3- benzothiazol- 2(3H)- ylidene]- 4- methoxybenzenesulfonamide
Smiles: OCC1CCCN1C(=O)c1ccc2c(c1)s/c(=N\S(=O)(=O)c1ccc(cc1)OC)/[nH]2

STK621460
Synonyms: N- cyclohexyl- 1- (1H- indol- 5- ylcarbonyl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)c1ccc2c(c1)cc[nH]2)NC1CCCCC1

STK621464
Synonyms: 2- [2- (3,4- dimethoxyphenyl)- 1,3- thiazol- 4- yl]- N- [4- (1H- 1,2,4- triazol- 1- ylmethyl)phenyl]acetamide
Smiles: COc1cc(ccc1OC)c1scc(n1)CC(=O)Nc1ccc(cc1)Cn1cncn1

STK621472
Synonyms: 8- (2,5- dimethyl- 1H- pyrrol- 1- yl)- 2- hydroxy- 3- (prop- 2- en- 1- yl)benzo[g]pteridin- 4(3H)- one
Smiles: C=CCn1c(O)nc2c(c1=O)nc1c(n2)cc(cc1)n1c(C)ccc1C

STK621475
Synonyms: 5- (1,3- benzodioxol- 5- yl)- 1- benzyl- 2- hydroxypyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(O)n(c2c1c(ccn2)c1ccc2c(c1)OCO2)Cc1ccccc1

STK621482
Synonyms: N- (4- hydroxyphenyl)- 2- [(2- methyl- 4- oxo- 3- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: O=C(Nc1ccc(cc1)O)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK621483
Synonyms: 1- [(4- hydroxyphthalazin- 1- yl)acetyl]piperidine- 4- carboxylicacid
Smiles: OC(=O)C1CCN(CC1)C(=O)Cc1nnc(c2c1cccc2)O

STK621484
Synonyms: N- (2- {[2- (5- chloro- 1H- indol- 3- yl)ethyl]carbamoyl}phenyl)- N'- [2- (dimethylamino)ethyl]ethanediamide
Smiles: CN(CCNC(=O)C(=O)Nc1ccccc1C(=O)NCCc1c[nH]c2c1cc(Cl)cc2)C

STK621485
Synonyms: N- (4- hydroxy- 2- methylphenyl)- 2- [(2- methyl- 4- oxo- 3- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: O=C(Nc1ccc(cc1C)O)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK621488
Synonyms: ethyl3- [4- hydroxy- 2- imino- 3- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 1- yl]benzoate
Smiles: CCOC(=O)c1cccc(c1)N1CC(=C(C1=N)c1scc(n1)C)O

STK621489
Synonyms: (3E)- 1- cyclohexyl- 3- (3,4- dihydroxybenzylidene)pyrrolidine- 2,5- dione
Smiles: O=C1C/C(=C\c2ccc(c(c2)O)O)/C(=O)N1C1CCCCC1

STK621490
Synonyms: (3Z)- 6- chloro- 3- (2- methoxybenzylidene)- 1- [(4- methylpiperazin- 1- yl)methyl]- 1,3- dihydro- 2H- indol- 2- one
Smiles: COc1ccccc1/C=C/1\C(=O)N(c2c1ccc(c2)Cl)CN1CCN(CC1)C

STK621491
Synonyms: 3- {3- [(4- fluorophenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl}- 1H- indole
Smiles: Fc1ccc(cc1)OCc1nnc2n1nc(s2)c1c[nH]c2c1cccc2

STK856330
Synonyms: (2Z)- 2- (2,3- dimethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methoxybenzenesulfonate
Smiles: COc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1cccc(c1OC)OC)/C2=O

STK621493
Synonyms: ethyl7- [(3- methoxybenzyl)oxy]- 3- (4- methoxyphenyl)- 4- oxo- 4H- chromene- 2- carboxylate
Smiles: CCOC(=O)c1oc2cc(OCc3cccc(c3)OC)ccc2c(=O)c1c1ccc(cc1)OC

STK621495
Synonyms: [2- (2,5- dimethyl- 1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl](thiomorpholin- 4- yl)methanone
Smiles: O=C(c1ccc2c(c1)sc(n2)n1c(C)ccc1C)N1CCSCC1

STK621496
Synonyms: N- cyclohexyl- 1- (1H- indol- 6- ylcarbonyl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)c1ccc2c(c1)[nH]cc2)NC1CCCCC1

STK621497
Synonyms: 4- (4,5- dimethyl- 1,3- thiazol- 2- yl)- 1- (4- hydroxy- 1,1- dioxidotetrahydrothiophen- 3- yl)- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1CS(=O)(=O)CC1N1CC(=C(C1=N)c1sc(c(n1)C)C)O

STK621500
Synonyms: 2- [5- (2- fluorophenyl)- 3- (4- methylphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- methyl- 1,3- thiazole
Smiles: Cc1ccc(cc1)C1=NN(C(C1)c1ccccc1F)c1scc(n1)C

STK621502
Synonyms: 2- (6- chloro- 7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- [(2R)- 2- hydroxypropyl]acetamide
Smiles: CC(CNC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)O

STK621504
Synonyms: 4- [3- (4- methylphenyl)- 4,6- dioxo- 3a,4,6,6a- tetrahydro- 5H- pyrrolo[3,4- d][1,2]oxazol- 5- yl]phenylacetate
Smiles: CC(=O)Oc1ccc(cc1)N1C(=O)C2C(C1=O)ON=C2c1ccc(cc1)C

STK621506
Synonyms: 1- (3,4- difluorophenyl)- N- (pyridin- 2- ylmethyl)- 1H- pyrazolo[3,4- d]pyrimidin- 4- amine
Smiles: Fc1ccc(cc1F)n1ncc2c1ncnc2NCc1ccccn1

STK621508
Synonyms: N- [3- cyano- 1- (4- methoxyphenyl)- 4,5- dimethyl- 1H- pyrrol- 2- yl]- 2- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)CC(=O)Nc1n(c2ccc(cc2)OC)c(c(c1C#N)C)C

STK621511
Synonyms: 2- methyl- 10H- thieno[2,3- b][1,5]benzodiazepin- 4- amine
Smiles: Cc1sc2c(c1)C(=Nc1c(N2)cccc1)N

STK621513
Synonyms: 3- [(4S)- 2,5- dioxo- 1- (2- phenylethyl)imidazolidin- 4- yl]- N- (2- fluorophenyl)propanamide
Smiles: O=C(Nc1ccccc1F)CC[C@@H]1NC(=O)N(C1=O)CCc1ccccc1

STK621514
Synonyms: 4- (2,5- dimethoxyphenyl)- 5- (furan- 2- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1n1c(=S)[nH]nc1c1ccco1)OC

STK621516
Synonyms: (5E)- 3- (4- bromo- 3- methylphenyl)- 6- hydroxy- 5- {[5- (piperidin- 1- yl)furan- 2- yl]methylidene}pyrimidine- 2,4(3H,5H)- dione
Smiles: O=C1N=C(O)/C(=C\c2ccc(o2)N2CCCCC2)/C(=O)N1c1ccc(c(c1)C)Br

STK856334
Synonyms: (2Z)- 2- (4- methylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2- methylpropanoate
Smiles: O=C(C(C)C)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)C)/C2=O

STK621518
Synonyms: N- butyl- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: CCCCNC(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK621519
Synonyms: 2- (ethylsulfanyl)- 5- [(pyrimidin- 2- ylsulfanyl)methyl][1,2,4]triazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCSc1nn2c(n1)nc(cc2O)CSc1ncccn1

STK621521
Synonyms: N- [2- (piperidin- 1- yl)ethyl]- N'- {2- [(pyridin- 2- ylmethyl)carbamoyl]phenyl}ethanediamide
Smiles: O=C(C(=O)Nc1ccccc1C(=O)NCc1ccccn1)NCCN1CCCCC1

STK621522
Synonyms: 1- (2- chloro- 7H- purin- 6- yl)- N- [2- (4- hydroxyphenyl)ethyl]piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2)NCCc1ccc(cc1)O

STK621527
Synonyms: N- (2- methylpropyl)- 1- (9H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: CC(CNC(=O)C1CCN(CC1)c1ncnc2c1nc[nH]2)C

STK621529
Synonyms: N- [1- (3,4- dimethylphenyl)- 2- hydroxy- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]pyridine- 3- carboxamide
Smiles: OC1=NC(C(=O)N1c1ccc(c(c1)C)C)(NC(=O)c1cccnc1)C(F)(F)F

STK621530
Synonyms: (6R)- N~6~- propyl- 4,5,6,7- tetrahydro- 1,3- benzothiazole- 2,6- diamine
Smiles: CCCN[C@@H]1CCc2c(C1)sc(n2)N

STK621531
Synonyms: 4- [(5Z)- 4- oxo- 5- (thiophen- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (quinoxalin- 6- yl)butanamide
Smiles: O=C(Nc1ccc2c(c1)nccn2)CCCN1C(=S)S/C(=C\c2cccs2)/C1=O

STK621533
Synonyms: methyl[(4- hydroxy- 5,6,7,8- tetrahydroquinazolin- 2- yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nc(O)c2c(n1)CCCC2

STK621534
Synonyms: 1- [3- (morpholin- 4- yl)propyl]- 1- (naphthalen- 1- ylmethyl)- 3- phenylurea
Smiles: O=C(N(Cc1cccc2c1cccc2)CCCN1CCOCC1)Nc1ccccc1

STK621535
Synonyms: 6- cyclohexyl- 2- hydroxy- 1- (4- methoxyphenyl)- 5,6,7,8- tetrahydropyrimido[4,5- d]pyrimidin- 4(1H)- one
Smiles: COc1ccc(cc1)n1c(O)nc(=O)c2c1NCN(C2)C1CCCCC1

STK856336
Synonyms: ethyl(2- amino- 4- hydroxy- 6- methylpyrimidin- 5- yl)acetate
Smiles: CCOC(=O)Cc1c(C)nc(nc1O)N

STK621540
Synonyms: 4- (1H- indol- 2- ylcarbonyl)- N- {(2S)- 1- [(3- methoxybenzyl)amino]- 1- oxopropan- 2- yl}piperazine- 1- carboxamide
Smiles: COc1cccc(c1)CNC(=O)[C@@H](NC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2)C

STK621543
Synonyms: 3- {[1- (4- fluorophenyl)- 1H- tetrazol- 5- yl]methoxy}benzoicacid
Smiles: Fc1ccc(cc1)n1nnnc1COc1cccc(c1)C(=O)O

STK621546
Synonyms: 9- [2- (morpholin- 4- yl)ethyl]- 3- phenyl- 2- (trifluoromethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: FC(c1oc2c3CN(CCN4CCOCC4)COc3ccc2c(=O)c1c1ccccc1)(F)F

STK621548
Synonyms: 3- cyano- 7- (4- hydroxyphenyl)- 5- methyl- N- phenyl- 1,7- dihydropyrazolo[1,5- a]pyrimidine- 6- carboxamide
Smiles: N#Cc1c[nH]n2c1=NC(=C(C2c1ccc(cc1)O)C(=O)Nc1ccccc1)C

STK621549
Synonyms: 3- {(3Z)- 2- (2,4- dimethoxyphenyl)- 3- [hydroxy(phenyl)methylidene]- 4,5- dioxopyrrolidin- 1- yl}propanoicacid
Smiles: COc1ccc(c(c1)OC)C1/C(=C(\c2ccccc2)/O)/C(=O)C(=O)N1CCC(=O)O

STK621551
Synonyms: 3- (furan- 2- yl)- 6- methyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Cc1nn2c(s1)nnc2c1ccco1

STK621552
Synonyms: 2- [(5E)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [3- (2- oxopyrrolidin- 1- yl)propyl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C/c2ccccc2)/C1=O)NCCCN1CCCC1=O

STK621558
Synonyms: 2- methoxy- 5- (4- methyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- N- phenylbenzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)Nc1ccccc1)N1C(=O)C(CS1(=O)=O)C

STK621560
Synonyms: 4- (1,3- benzothiazol- 2- yl)- 1- {[(E)- (1- ethyl- 3- methyl- 1H- pyrazol- 4- yl)methylidene]amino}- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: CCn1nc(c(c1)/C=N/N1CC(=C(C1=N)c1nc2c(s1)cccc2)O)C

STK856339
Synonyms: 2- [(8- methoxy- 4- methylquinazolin- 2- yl)amino]- 5,6,7,8- tetrahydroquinazolin- 4- ol
Smiles: COc1cccc2c1nc(Nc1nc(O)c3c(n1)CCCC3)nc2C

STK621562
Synonyms: 4- (1H- indol- 2- ylcarbonyl)- N- {3- oxo- 3- [(pyridin- 3- ylmethyl)amino]propyl}piperazine- 1- carboxamide
Smiles: O=C(NCc1cccnc1)CCNC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2

STK621563
Synonyms: N- (2,3- dimethylphenyl)- 3- [(4S)- 1- (furan- 2- ylmethyl)- 2,5- dioxoimidazolidin- 4- yl]propanamide
Smiles: O=C(Nc1cccc(c1C)C)CC[C@@H]1NC(=O)N(C1=O)Cc1ccco1

STK621565
Synonyms: 2- [(1'- acetyl- 4- oxo- 3,4- dihydrospiro[chromene- 2,4'- piperidin]- 7- yl)oxy]- N- (furan- 2- ylmethyl)acetamide
Smiles: O=C(NCc1ccco1)COc1ccc2c(c1)OC1(CC2=O)CCN(CC1)C(=O)C

STK621570
Synonyms: N- (4- chlorophenyl)- 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)Cl)CSc1nc(Cl)nc2c1[nH]cn2

STK621578
Synonyms: ethyl{4- [4- cyano- 1- (propan- 2- yl)- 6,7- dihydro- 5H- cyclopenta[c]pyridin- 3- yl]piperazin- 1- yl}(oxo)acetate
Smiles: CCOC(=O)C(=O)N1CCN(CC1)c1nc(C(C)C)c2c(c1C#N)CCC2

STK856340
Synonyms: (2Z)- 2- [(6- bromo- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 6- ethoxy- 1- benzofuran- 3(2H)- one
Smiles: CCOc1ccc2c(c1)O/C(=C\c1cc(Br)cc3c1OCOC3)/C2=O

STK621583
Synonyms: N- (2,1,3- benzoxadiazol- 4- yl)- 3- {(5Z)- 4- oxo- 5- [(2E)- 3- phenylprop- 2- en- 1- ylidene]- 2- thioxo- 1,3- thiazolidin- 3- yl}propanamide
Smiles: O=C(Nc1cccc2c1non2)CCN1C(=S)S/C(=C\C=C\c2ccccc2)/C1=O

STK621584
Synonyms: 5- (1,3- benzodioxol- 5- yl)- 2- hydroxy- 1- (tetrahydrofuran- 2- ylmethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(O)n(c2c1c(ccn2)c1ccc2c(c1)OCO2)CC1CCCO1

STK621586
Synonyms: N- [(1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- yl)methyl]- 2- [(4- hydroxyquinazolin- 2- yl)sulfanyl]propanamide
Smiles: CC(C(=O)NCc1cc(=O)n(c(=O)n1C)C)Sc1nc(O)c2c(n1)cccc2

STK621588
Synonyms: 1- (3,4- dimethoxybenzyl)- 3- (4- methylphenyl)- 1- [2- (morpholin- 4- yl)ethyl]thiourea
Smiles: COc1cc(ccc1OC)CN(C(=S)Nc1ccc(cc1)C)CCN1CCOCC1

STK621590
Synonyms: 4- (2- chlorobenzyl)- 2- (4- methoxyphenyl)- 5- methyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccc(cc1)n1[nH]c(c(c1=O)Cc1ccccc1Cl)C

STK621591
Synonyms: 3- [(E)- 2- (2,6- dihydroxy- 5- nitropyrimidin- 4- yl)ethenyl]- 4H- chromen- 4- one
Smiles: Oc1nc(/C=C/c2coc3c(c2=O)cccc3)c(c(n1)O)[N+](=O)[O-]

STK621592
Synonyms: 4- (1H- indol- 3- ylcarbonyl)- N- {3- oxo- 3- [(pyridin- 4- ylmethyl)amino]propyl}piperazine- 1- carboxamide
Smiles: O=C(NCc1ccncc1)CCNC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2

STK621594
Synonyms: 4- [(2- chloro- 7H- purin- 6- yl)amino]- N- [3- (1H- imidazol- 1- yl)propyl]butanamide
Smiles: O=C(NCCCn1cncc1)CCCNc1nc(Cl)nc2c1[nH]cn2

STK621596
Synonyms: 3- (4- chlorophenyl)- 9- [3- (morpholin- 4- yl)propyl]- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: Clc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CCCN2CCOCC2)CO1

STK621599
Synonyms: 2- (7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- [(3- phenyl- 1,2,4- oxadiazol- 5- yl)methyl]acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)ccc(c2)O)NCc1onc(n1)c1ccccc1

STK621602
Synonyms: N- (2- chlorophenyl)- 2- [2- (4- methylpiperazin- 1- yl)ethyl]piperidine- 1- carbothioamide
Smiles: CN1CCN(CC1)CCC1CCCCN1C(=S)Nc1ccccc1Cl

STK621605
Synonyms: 5- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- 2- methoxy- N- [2- (3- methoxyphenyl)ethyl]benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)NCCc1cccc(c1)OC)N1C(=O)C(CS1(=O)=O)(C)C

STK621607
Synonyms: N- (2- methoxy- 5- methylphenyl)- 2- {[3- (4- methoxyphenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}acetamide
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1cc(C)ccc1OC

STK621609
Synonyms: 2- (3,4- dimethoxyphenyl)- 7- (4- fluorophenyl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1cc(ccc1OC)c1nn2c(n1)c1c(nc2)n(c(c1C)C)c1ccc(cc1)F

STK621611
Synonyms: N- (2- {[2- (1H- indol- 3- yl)ethyl]carbamoyl}phenyl)- N'- (pyridin- 2- ylmethyl)ethanediamide
Smiles: O=C(C(=O)Nc1ccccc1C(=O)NCCc1c[nH]c2c1cccc2)NCc1ccccn1

STK621616
Synonyms: 2- (1,3- benzodioxol- 5- yl)- 3- (4- hydroxyphenyl)- 2,3- dihydroquinazolin- 4(1H)- one
Smiles: Oc1ccc(cc1)N1C(Nc2c(C1=O)cccc2)c1ccc2c(c1)OCO2

STK621617
Synonyms: N- ({4- [4- (1H- indol- 3- yl)butanoyl]piperazin- 1- yl}carbonyl)- L- alanine
Smiles: OC(=O)[C@@H](NC(=O)N1CCN(CC1)C(=O)CCCc1c[nH]c2c1cccc2)C

STK621618
Synonyms: N- cyclopropyl- 3- [(4S)- 1- (4- methoxybenzyl)- 2,5- dioxoimidazolidin- 4- yl]propanamide
Smiles: COc1ccc(cc1)CN1C(=O)N[C@H](C1=O)CCC(=O)NC1CC1

STK621620
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl3,4- dimethoxybenzoate
Smiles: COc1cc(ccc1OC)C(=O)Oc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O

STK621621
Synonyms: 3- [(4S)- 1- (1,3- benzodioxol- 5- ylmethyl)- 2,5- dioxoimidazolidin- 4- yl]- N- (2,3- dihydro- 1,4- benzodioxin- 6- yl)propanamide
Smiles: O=C(Nc1ccc2c(c1)OCCO2)CC[C@@H]1NC(=O)N(C1=O)Cc1ccc2c(c1)OCO2

STK621627
Synonyms: 4- (3- chlorophenyl)- 1,2,5- thiadiazolidin- 3- imine1,1- dioxide
Smiles: N=C1NS(=O)(=O)NC1c1cccc(c1)Cl

STK621629
Synonyms: 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]propanoicacid
Smiles: OC(=O)CCSc1nc(Cl)nc2c1[nH]cn2

STK621633
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2- methoxybenzoate
Smiles: COc1ccccc1C(=O)Oc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O

STK621635
Synonyms: 1- {[4- (acetylamino)phenyl]sulfonyl}- N- [3- (1H- imidazol- 1- yl)propyl]piperidine- 3- carboxamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCCC(C1)C(=O)NCCCn1cncc1

STK621636
Synonyms: N- [2- (2- oxo- 2,6,7,8- tetrahydrocyclopenta[g]chromen- 4- yl)- 1- benzofuran- 3- yl]cyclohexanecarboxamide
Smiles: O=c1oc2cc3CCCc3cc2c(c1)c1oc2c(c1NC(=O)C1CCCCC1)cccc2

STK621637
Synonyms: 2- {(pyridin- 3- ylmethyl)[2- (pyrrolidin- 1- ylsulfonyl)ethyl]carbamoyl}benzoicacid
Smiles: OC(=O)c1ccccc1C(=O)N(Cc1cccnc1)CCS(=O)(=O)N1CCCC1

STK621638
Synonyms: (2Z)- 2- (2- chlorobenzylidene)- 8- (pyridin- 3- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2ccccc2Cl)/Oc2c1ccc1c2CN(CO1)Cc1cccnc1

STK621639
Synonyms: 4- [4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (3- methoxyphenyl)- 1,3- oxazol- 5- yl]morpholine
Smiles: COc1cccc(c1)c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)N1CCOCC1

STK621642
Synonyms: 1- [(4- chlorophenyl)sulfonyl]- N- {2- [(2- hydroxyethyl)(methyl)amino]- 2- oxoethyl}piperidine- 3- carboxamide
Smiles: OCCN(C(=O)CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)Cl)C

STK856342
Synonyms: (2Z)- 7- {[bis(2- methoxyethyl)ammonio]methyl}- 2- (1H- indol- 3- ylmethylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: COCC[NH+](Cc1c([O-])ccc2c1O/C(=C\c1c[nH]c3c1cccc3)/C2=O)CCOC

STK621643
Synonyms: methyl[7- hydroxy- 2- (methylsulfanyl)[1,2,4]triazolo[1,5- a]pyrimidin- 5- yl]acetate
Smiles: COC(=O)Cc1cc(O)n2c(n1)nc(n2)SC

STK621647
Synonyms: (2Z)- 2- (2- methoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yldiphenylcarbamate
Smiles: COc1ccccc1/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)N(c1ccccc1)c1ccccc1

STK621648
Synonyms: {2- [5- hydroxy- 4- methyl- 4- (propan- 2- yl)- 4H- imidazol- 2- yl]quinolin- 3- yl}(thiomorpholin- 4- yl)methanone
Smiles: O=C(c1cc2ccccc2nc1C1=NC(C(=N1)O)(C)C(C)C)N1CCSCC1

STK621650
Synonyms: methyl(2Z)- 2- {[(3- bromophenyl)carbonyl]imino}- 2,3- dihydro- 1,3- benzothiazole- 6- carboxylate
Smiles: COC(=O)c1ccc2c(c1)s/c(=N\C(=O)c1cccc(c1)Br)/[nH]2

STK621652
Synonyms: 3- [2- (1,3- benzothiazol- 2- yl)- 5- methyl- 3- oxo- 2,3- dihydro- 1H- pyrazol- 4- yl]- 1- phenylpyrrolidine- 2,5- dione
Smiles: O=C1CC(C(=O)N1c1ccccc1)c1c(C)[nH]n(c1=O)c1nc2c(s1)cccc2

STK621654
Synonyms: ethyl[(2Z)- 2- [(cyclopropylcarbonyl)imino]- 4- (4- methylphenyl)- 2,3- dihydro- 1,3- thiazol- 5- yl]carbamate
Smiles: CCOC(=O)Nc1s/c(=N\C(=O)C2CC2)/[nH]c1c1ccc(cc1)C

STK621655
Synonyms: 2- methoxy- N- [(2Z)- 3- methyl- 5,5- dioxidotetrahydrothieno[3,4- d][1,3]thiazol- 2(3H)- ylidene]acetamide
Smiles: COCC(=O)/N=C/1\SC2C(N1C)CS(=O)(=O)C2

STK621656
Synonyms: 4- (4- hydroxy- 3- methoxyphenyl)- 3- methyl- 1- phenyl- 1H- pyrazolo[4',3':5,6]pyrido[2,3- d]pyrimidine- 5,7- diol
Smiles: COc1cc(ccc1O)c1c2c(C)nn(c2nc2c1c(O)nc(n2)O)c1ccccc1

STK621657
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (4- methoxyphenyl)- N,N- dimethyl- 1,3- oxazol- 5- amine
Smiles: COc1ccc(cc1)c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)N(C)C

STK621658
Synonyms: 2- [(4- methyl- 2- oxo- 2H- chromen- 7- yl)oxy]- N- {[1- (4- methylpiperazin- 1- yl)cyclohexyl]methyl}acetamide
Smiles: CN1CCN(CC1)C1(CCCCC1)CNC(=O)COc1ccc2c(c1)oc(=O)cc2C

STK621659
Synonyms: 2- amino- 7- [(4- bromobenzyl)oxy]- 3- (4- methoxyphenyl)- 4H- chromen- 4- one
Smiles: COc1ccc(cc1)c1c(N)oc2c(c1=O)ccc(c2)OCc1ccc(cc1)Br

STK621660
Synonyms: 2- (4- methoxyphenyl)- 5- (trifluoromethyl)- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccc(cc1)n1[nH]c(cc1=O)C(F)(F)F

STK621661
Synonyms: N- [3- (5,7- dimethyl- 1,3- benzoxazol- 2- yl)- 4- hydroxyphenyl]- 2- (4- nitrophenoxy)acetamide
Smiles: O=C(Nc1ccc(c(c1)c1nc2c(o1)c(C)cc(c2)C)O)COc1ccc(cc1)[N+](=O)[O-]

STK621663
Synonyms: N- [2- (5- methoxy- 1H- indol- 3- yl)ethyl]- N'- [2- (pyrrolidin- 1- ylcarbonyl)phenyl]ethanediamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)C(=O)Nc1ccccc1C(=O)N1CCCC1)c[nH]2

STK621664
Synonyms: 1- {[(9- oxo- 1,2,3,9- tetrahydropyrrolo[2,1- b]quinazolin- 7- yl)oxy]acetyl}piperidine- 3- carboxylicacid
Smiles: OC(=O)C1CCCN(C1)C(=O)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK621665
Synonyms: 2- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)- N- [2- (1H- imidazol- 4- yl)ethyl]acetamide
Smiles: O=C(Cc1nn2c(n1)nc(cc2O)C)NCCc1c[nH]cn1

STK856344
Synonyms: (2Z)- 3- oxo- 2- (thiophen- 2- ylmethylidene)- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzenesulfonate
Smiles: Fc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O

STK621669
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzenesulfonate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OS(=O)(=O)c1ccc(cc1)Cl)cn2C

STK621670
Synonyms: (4E)- 4- ({[2- (1H- indol- 3- yl)ethyl]amino}methylidene)- 2- phenylisoquinoline- 1,3(2H,4H)- dione
Smiles: O=C1/C(=C/NCCc2c[nH]c3c2cccc3)/c2ccccc2C(=O)N1c1ccccc1

STK621673
Synonyms: 3- (2- chlorophenyl)- N- (furan- 2- ylmethyl)- 1,2- oxazole- 4- carboxamide
Smiles: O=C(c1conc1c1ccccc1Cl)NCc1ccco1

STK621674
Synonyms: N- [3- cyano- 1- (furan- 2- ylmethyl)- 4,5- dimethyl- 1H- pyrrol- 2- yl]- 2- (4- methoxyphenoxy)acetamide
Smiles: COc1ccc(cc1)OCC(=O)Nc1n(Cc2ccco2)c(c(c1C#N)C)C

STK856345
Synonyms: N,N- bis(2- methoxyethyl)- 1,3- diphenyl- 1H- thieno[2,3- c]pyrazole- 5- carboxamide
Smiles: COCCN(C(=O)c1sc2c(c1)c(nn2c1ccccc1)c1ccccc1)CCOC

STK621683
Synonyms: 5,6- dimethyl- 7- (pyridin- 2- yl)- 3- (pyridin- 4- ylmethyl)- 3,7- dihydro- 4H- pyrrolo[2,3- d]pyrimidin- 4- imine
Smiles: Cc1n(c2ccccn2)c2c(c1C)c(=N)n(cn2)Cc1ccncc1

STK621686
Synonyms: 2'- amino- 5- fluoro- 1- [2- (morpholin- 4- yl)ethyl]- 2,5'- dioxo- 1,2- dihydro- 5'H- spiro[indole- 3,4'- pyrano[3,2- c]chromene]- 3'- carbonitrile
Smiles: N#CC1=C(N)Oc2c(C31c1cc(F)ccc1N(C3=O)CCN1CCOCC1)c(=O)oc1c2cccc1

STK621688
Synonyms: 2,5,6- trihydroxy- 5- (5- hydroxy- 3- phenyl- 1H- pyrazol- 4- yl)pyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)C(C(=N1)O)(O)c1c(O)[nH]nc1c1ccccc1

STK621689
Synonyms: 2- {[1- (2,4- dimethylphenyl)- 5,5- dioxido- 3a,4,6,6a- tetrahydro- 1H- thieno[3,4- d]imidazol- 2- yl]sulfanyl}- N,N- dimethylacetamide
Smiles: Cc1ccc(c(c1)C)N1C(=NC2C1CS(=O)(=O)C2)SCC(=O)N(C)C

STK621694
Synonyms: 3- [3- (3- bromophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]- 1H- indole
Smiles: Brc1cccc(c1)c1nnc2n1nc(s2)c1c[nH]c2c1cccc2

STK621695
Synonyms: methyl2- {[{[2- (5- chloro- 1H- indol- 3- yl)ethyl]amino}(oxo)acetyl]amino}- 4,5- dimethylthiophene- 3- carboxylate
Smiles: COC(=O)c1c(NC(=O)C(=O)NCCc2c[nH]c3c2cc(Cl)cc3)sc(c1C)C

STK856347
Synonyms: 7- [2- (4- chlorophenyl)- 2- oxoethoxy]- 3- (2- methoxyphenyl)- 2- methyl- 4H- chromen- 4- one
Smiles: COc1ccccc1c1c(C)oc2c(c1=O)ccc(c2)OCC(=O)c1ccc(cc1)Cl

STK621706
Synonyms: 2- [(2- methyl- 4- oxo- 3- phenoxy- 4H- chromen- 7- yl)oxy]- N- (6- methylpyridin- 2- yl)acetamide
Smiles: O=C(Nc1cccc(n1)C)COc1ccc2c(c1)oc(c(c2=O)Oc1ccccc1)C

STK621709
Synonyms: 2- [2- (9,10- dihydro- 8H- cyclopenta[4,5]thieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 5- ylamino)ethoxy]ethanol
Smiles: OCCOCCNc1nc2sc3c(c2c2n1ncn2)CCC3

STK621711
Synonyms: 2- [(5E)- 5- benzylidene- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [(3S,4R)- 4- hydroxytetrahydrothiophen- 3- yl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C/c2ccccc2)/C1=O)N[C@@H]1CSC[C@@H]1O

STK621712
Synonyms: (2Z)- 2- (3- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl2- methylpropanoate
Smiles: O=C(C(C)C)Oc1ccc2c(c1)O/C(=C\c1cccc(c1)Br)/C2=O

STK621713
Synonyms: 6- butyl- 10- methyl- 3- (pyridin- 2- yl)- 3,4- dihydro- 2H,8H- chromeno[6,7- e][1,3]oxazin- 8- one
Smiles: CCCCc1cc(=O)oc2c1cc1CN(COc1c2C)c1ccccn1

STK621715
Synonyms: 7- [(2- fluorobenzyl)oxy]- 2,3- dihydropyrrolo[2,1- b]quinazolin- 9(1H)- one
Smiles: Fc1ccccc1COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK621716
Synonyms: 1- cyclopentyl- 5- imino- 4- (4- phenyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2scc(n2)c2ccccc2)C(=N)N(C1)C1CCCC1

STK621717
Synonyms: (2Z)- 2- (4- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methylbenzenesulfonate
Smiles: Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)Br)/C2=O

STK621718
Synonyms: 1- [4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- phenyl- 1,3- oxazol- 5- yl]- 4- methylpiperazine
Smiles: CN1CCN(CC1)c1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccccc1

STK621719
Synonyms: 1- [4- (4- fluorophenyl)piperazin- 1- yl]- 2- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)ethanone
Smiles: Fc1ccc(cc1)N1CCN(CC1)C(=O)Cc1nn2c(n1)nc(cc2O)C

STK621721
Synonyms: 4- (1H- indol- 3- ylcarbonyl)- N- [(2S)- 1- oxo- 1- (1,3- thiazol- 2- ylamino)propan- 2- yl]piperazine- 1- carboxamide
Smiles: O=C([C@@H](NC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2)C)Nc1nccs1

STK621722
Synonyms: (2Z)- 2- (3- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl(2E)- 3- phenylprop- 2- enoate
Smiles: O=C(Oc1ccc2c(c1)O/C(=C\c1cccc(c1)F)/C2=O)/C=C/c1ccccc1

STK621725
Synonyms: N- (5- chloropyridin- 2- yl)- 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4,5,6,7- tetrahydro- 1H- indazole- 3- carboxamide
Smiles: Clc1ccc(nc1)NC(=O)c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1

STK621726
Synonyms: (2Z)- 2- (4- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methylbenzenesulfonate
Smiles: Cc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(cc1)F)/C2=O

STK621728
Synonyms: 2- [(2- benzyl- 7,8- dihydro- 6H- thiopyrano[3,2- d]pyrimidin- 4- yl)sulfanyl]acetamide
Smiles: NC(=O)CSc1nc(Cc2ccccc2)nc2c1SCCC2

STK621729
Synonyms: 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl]- 3- (thiophen- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2c1cccs1)C

STK621733
Synonyms: trans- N- {2- [(1,3- benzodioxol- 5- ylmethyl)amino]- 2- oxoethyl}- 4- {[(phenylsulfonyl)amino]methyl}cyclohexanecarboxamide
Smiles: O=C(NCc1ccc2c(c1)OCO2)CNC(=O)[C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1

STK621736
Synonyms: (2E)- 2- [(1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- bromobenzoate
Smiles: Brc1ccc(cc1)C(=O)Oc1ccc2c(c1)O/C(=C/c1cn(c3c1cccc3)C)/C2=O

STK621737
Synonyms: 4- [(2- chloro- 7H- purin- 6- yl)amino]- N- (pyridin- 4- ylmethyl)butanamide
Smiles: O=C(NCc1ccncc1)CCCNc1nc(Cl)nc2c1[nH]cn2

STK621738
Synonyms: 3- chloro- 10- (thiophen- 2- ylcarbonyl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: Clc1ccc2c(c1)C=CC1N2C(C2C1C(=O)NC2=O)C(=O)c1cccs1

STK621745
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- N- (2- methoxyethyl)- 2- (2- methoxyphenyl)- 1,3- oxazol- 5- amine
Smiles: COCCNc1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccccc1OC

STK621746
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (furan- 2- yl)- N- (pyridin- 3- ylmethyl)- 1,3- oxazol- 5- amine
Smiles: O=S(=O)(c1nc(oc1NCc1cccnc1)c1ccco1)c1ccc2c(c1)OCCO2

STK621747
Synonyms: (2Z)- 8- (pyridin- 3- ylmethyl)- 2- (2,4,5- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(OC)c(cc1/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1cccnc1)OC

STK621748
Synonyms: 6- benzyl- 3- {[(1- phenyl- 1H- tetrazol- 5- yl)methyl]sulfanyl}- 1,2,4- triazin- 5- ol
Smiles: Oc1nc(nnc1Cc1ccccc1)SCc1nnnn1c1ccccc1

STK621749
Synonyms: N- {(2S)- 1- [(furan- 2- ylmethyl)amino]- 1- oxopropan- 2- yl}- 4- (1H- indol- 3- ylcarbonyl)piperazine- 1- carboxamide
Smiles: C[C@@H](C(=O)NCc1ccco1)NC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2

STK621751
Synonyms: 1- (4- hydroxy- 6- phenylpyrimidin- 2- yl)- 3- (4- phenoxyphenyl)guanidine
Smiles: N=C(Nc1nc(O)cc(n1)c1ccccc1)Nc1ccc(cc1)Oc1ccccc1

STK621753
Synonyms: 2- {[4- methyl- 5- (pyridin- 4- yl)- 4H- 1,2,4- triazol- 3- yl]sulfanyl}- N- [(2E)- 5- (trifluoromethyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]acetamide
Smiles: O=C(/N=c/1\[nH]nc(s1)C(F)(F)F)CSc1nnc(n1C)c1ccncc1

STK621754
Synonyms: 5- amino- 1- (3- hydroxyquinoxalin- 2- yl)- 1H- pyrazole- 4- carbonitrile
Smiles: N#Cc1cnn(c1N)c1nc2ccccc2nc1O

STK856350
Synonyms: 6- [3- (3- methoxyphenyl)- 1- (methylsulfonyl)- 4,5- dihydro- 1H- pyrazol- 5- yl]quinoxaline
Smiles: COc1cccc(c1)C1=NN(C(C1)c1ccc2c(c1)nccn2)S(=O)(=O)C

STK621757
Synonyms: 3- methyl- 2- phenyl- 8- (pyrrolidin- 1- ylcarbonyl)- 4H- chromen- 4- one
Smiles: O=C(c1cccc2c1oc(c1ccccc1)c(c2=O)C)N1CCCC1

STK621759
Synonyms: (2E)- N- (3- acetylphenyl)- 2- {[(4- methoxyphenyl)sulfonyl]imino}- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c\1/sc2c([nH]1)ccc(c2)C(=O)Nc1cccc(c1)C(=O)C

STK856351
Synonyms: (2Z)- 2- (2,3- dimethoxybenzylidene)- 8- (pyridin- 3- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1c(cccc1OC)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1cccnc1

STK621760
Synonyms: (2E)- N- (3- hydroxyphenyl)- 2- {[(4- methoxyphenyl)sulfonyl]imino}- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c\1/sc2c([nH]1)ccc(c2)C(=O)Nc1cccc(c1)O

STK621768
Synonyms: 2- (4- hydroxyphthalazin- 1- yl)- N- (5- methyl- 1,3- thiazol- 2- yl)acetamide
Smiles: O=C(Cc1nnc(c2c1cccc2)O)Nc1ncc(s1)C

STK621769
Synonyms: 4- [4- (4- chlorophenyl)- 1,3- thiazol- 2- yl]- 5- imino- 1- (propan- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Clc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)C(C)C

STK621771
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (2- methylphenyl)- N- [2- (morpholin- 4- yl)ethyl]- 1,3- oxazol- 5- amine
Smiles: Cc1ccccc1c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NCCN1CCOCC1

STK621772
Synonyms: 3- (2- methoxyphenyl)- 2- methyl- 9- (pyridin- 4- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccccc1c1c(C)oc2c(c1=O)ccc1c2CN(CO1)Cc1ccncc1

STK621776
Synonyms: 4- {[3- (1H- imidazol- 1- yl)propyl]amino}tetrahydrothiophene- 3- ol1,1- dioxide
Smiles: OC1CS(=O)(=O)CC1NCCCn1cncc1

STK621777
Synonyms: (5Z)- 3- [2- (3,4- dimethoxyphenyl)ethyl]- 5- (quinolin- 8- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1cc(CCN2C(=S)S/C(=C\c3cccc4c3nccc4)/C2=O)ccc1OC

STK621778
Synonyms: methylN- {[4- (8- chloro- 5,6- dihydro- 11H- benzo[5,6]cyclohepta[1,2- b]pyridin- 11- ylidene)piperidin- 1- yl]carbonyl}glycinate
Smiles: COC(=O)CNC(=O)N1CCC(=C2c3ccc(cc3CCc3c2nccc3)Cl)CC1

STK621780
Synonyms: 6- (5- bromopyridin- 3- yl)- 3- (3- methoxyphenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1cccc(c1)c1nnc2n1nc(s2)c1cncc(c1)Br

STK621782
Synonyms: 2- chloro- 5- [3- (4- ethoxyphenyl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]benzoicacid
Smiles: CCOc1ccc(cc1)c1n[nH]c(=S)n1c1ccc(c(c1)C(=O)O)Cl

STK621787
Synonyms: N- (4'- cyano- 2,2':3',2''- terfuran- 5'- yl)- 2- (2,6- dimethylphenoxy)acetamide
Smiles: N#Cc1c(NC(=O)COc2c(C)cccc2C)oc(c1c1ccco1)c1ccco1

STK621789
Synonyms: N- (9,10- dioxo- 9,10- dihydroanthracen- 1- yl)- N~2~- (2- hydroxyethyl)- N~2~- methylglycinamide
Smiles: OCCN(CC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O)C

STK621791
Synonyms: N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]- N- [(3- phenyl- 1,2,4- oxadiazol- 5- yl)methyl]glycinamide
Smiles: O=C(NCc1onc(n1)c1ccccc1)CNC(=O)Cc1nnc(c2c1cccc2)O

STK621795
Synonyms: 3- butoxy- N- [(2Z)- 5- (methylsulfonyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]benzamide
Smiles: CCCCOc1cccc(c1)C(=O)/N=c\1/[nH]nc(s1)S(=O)(=O)C

STK621800
Synonyms: N- (5- chloro- 2- methylphenyl)- 3- {(4S)- 2,5- dioxo- 1- [(1S)- 1- phenylethyl]imidazolidin- 4- yl}propanamide
Smiles: O=C(Nc1cc(Cl)ccc1C)CC[C@@H]1NC(=O)N(C1=O)[C@H](c1ccccc1)C

STK621804
Synonyms: methyl{7- hydroxy- 2- [(2- methoxy- 2- oxoethyl)sulfanyl][1,2,4]triazolo[1,5- a]pyrimidin- 5- yl}acetate
Smiles: COC(=O)CSc1nc2n(n1)c(O)cc(n2)CC(=O)OC

STK621805
Synonyms: 4- amino- N- [1- (2- chlorophenyl)- 2- hydroxy- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]benzenesulfonamide
Smiles: Nc1ccc(cc1)S(=O)(=O)NC1(N=C(N(C1=O)c1ccccc1Cl)O)C(F)(F)F

STK621806
Synonyms: N- [3- (1H- imidazol- 1- yl)propyl]- 3- {(5E)- 4- oxo- 5- [(2E)- 3- phenylprop- 2- en- 1- ylidene]- 2- thioxo- 1,3- thiazolidin- 3- yl}propanamide
Smiles: O=C(CCN1C(=S)S/C(=C/C=C/c2ccccc2)/C1=O)NCCCn1cncc1

STK621808
Synonyms: ethyl1- {[1- (2- chloro- 7H- purin- 6- yl)piperidin- 3- yl]carbonyl}piperidine- 4- carboxylate
Smiles: CCOC(=O)C1CCN(CC1)C(=O)C1CCCN(C1)c1nc(Cl)nc2c1[nH]cn2

STK856353
Synonyms: 2- [(2- methoxyethyl)sulfanyl]- 4- (trifluoromethyl)- 5,6,7,8- tetrahydroquinoline- 3- carbonitrile
Smiles: COCCSc1nc2CCCCc2c(c1C#N)C(F)(F)F

STK621810
Synonyms: 4- cyclopropyl- 5- (pyridin- 4- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1C1CC1)c1ccncc1

STK621811
Synonyms: 2- (ethylsulfanyl)- 1- (4- methoxybenzyl)- 3a,4,6,6a- tetrahydro- 1H- thieno[3,4- d]imidazole5,5- dioxide
Smiles: CCSC1=NC2C(N1Cc1ccc(cc1)OC)CS(=O)(=O)C2

STK621812
Synonyms: 8- [(dimethylamino)methyl]- 7- hydroxy- 3- phenoxy- 4H- chromen- 4- one
Smiles: CN(Cc1c(O)ccc2c1occ(c2=O)Oc1ccccc1)C

STK621815
Synonyms: N'- [4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (furan- 2- yl)- 1,3- oxazol- 5- yl]- N,N- diethylpropane- 1,3- diamine
Smiles: CCN(CCCNc1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccco1)CC

STK621818
Synonyms: N- (3- methoxypropyl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: COCCCNC(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK621819
Synonyms: N- [(3- phenyl- 1,2,4- oxadiazol- 5- yl)methyl]- 1- (pyrimidin- 2- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncccn1)NCc1onc(n1)c1ccccc1

STK621822
Synonyms: 6- (3- bromo- 4- fluorophenyl)- 3- cyclohexyl[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Fc1ccc(cc1Br)c1nn2c(s1)nnc2C1CCCCC1

STK621824
Synonyms: 2- [(5E)- 4- oxo- 5- (quinoxalin- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]pentanedioicacid
Smiles: OC(=O)CCC(N1C(=S)S/C(=C/c2cnc3c(n2)cccc3)/C1=O)C(=O)O

STK621829
Synonyms: 3- (7- hydroxy- 5- methyl- 2- phenyl[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl)propanenitrile
Smiles: N#CCCc1c(C)nc2n(c1O)nc(n2)c1ccccc1

STK621831
Synonyms: (E)- N- {[8,9- dimethyl- 7- (1,3- thiazol- 2- yl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}- 1- (2- methoxyphenyl)methanimine
Smiles: COc1ccccc1/C=N/OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)c1nccs1

STK621834
Synonyms: 4- (1H- indol- 3- ylcarbonyl)- N- {3- oxo- 3- [(pyridin- 2- ylmethyl)amino]propyl}piperazine- 1- carboxamide
Smiles: O=C(NCc1ccccn1)CCNC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2

STK856354
Synonyms: 2- (2- chlorophenyl)- 6- methoxy- 4H- chromen- 4- one
Smiles: COc1ccc2c(c1)c(=O)cc(o2)c1ccccc1Cl

STK621839
Synonyms: N- [3- cyano- 1- (furan- 2- ylmethyl)- 4,5- dimethyl- 1H- pyrrol- 2- yl]- 1H- indole- 3- carboxamide
Smiles: N#Cc1c(C)c(n(c1NC(=O)c1c[nH]c2c1cccc2)Cc1ccco1)C

STK621840
Synonyms: 4- (4,5- dimethyl- 1,3- thiazol- 2- yl)- 1- (2- hydroxypropyl)- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: CC(CN1CC(=C(C1=N)c1sc(c(n1)C)C)O)O

STK621842
Synonyms: 3- (3- chlorophenyl)- 1- methyl- 1- [(4- oxo- 1,2- dihydro- 4H- pyrrolo[3,2,1- ij]quinolin- 5- yl)methyl]urea
Smiles: Clc1cccc(c1)NC(=O)N(Cc1cc2cccc3c2n(c1=O)CC3)C

STK621844
Synonyms: ethyl[2- amino- 4- (4- fluorophenyl)- 1,3- thiazol- 5- yl]carbamate
Smiles: CCOC(=O)Nc1sc(nc1c1ccc(cc1)F)N

STK621847
Synonyms: N- [2- ({[1- (7H- purin- 6- yl)piperidin- 3- yl]carbonyl}amino)ethyl]pyridine- 4- carboxamide
Smiles: O=C(C1CCCN(C1)c1ncnc2c1[nH]cn2)NCCNC(=O)c1ccncc1

STK621850
Synonyms: 3- amino- 6- (pyridin- 2- yl)thieno[2,3- b]pyridine- 2- carbonitrile
Smiles: N#Cc1sc2c(c1N)ccc(n2)c1ccccn1

STK621852
Synonyms: 4- [2- (pyridin- 4- yl)ethyl]- N- [4- (trifluoromethyl)phenyl]piperazine- 1- carbothioamide
Smiles: S=C(N1CCN(CC1)CCc1ccncc1)Nc1ccc(cc1)C(F)(F)F

STK621855
Synonyms: 3- (4- oxo- 1,2,3- benzotriazin- 3(4H)- yl)- N- (pyridin- 3- ylmethyl)propanamide
Smiles: O=C(CCn1nnc2c(c1=O)cccc2)NCc1cccnc1

STK621856
Synonyms: 5- (furan- 2- yl)- 2- hydroxy- 1- methylpyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: O=c1nc(O)n(c2c1c(ccn2)c1ccco1)C

STK621857
Synonyms: N- (5- carbamoyl- 1- methyl- 1H- pyrazol- 4- yl)- N'- [2- (1H- indol- 3- yl)ethyl]ethanediamide
Smiles: O=C(C(=O)NCCc1c[nH]c2c1cccc2)Nc1cnn(c1C(=O)N)C

STK621858
Synonyms: (E)- 1- (3,4- dimethoxyphenyl)- N- {[8,9- dimethyl- 7- (pyridin- 4- ylmethyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}methanimine
Smiles: COc1cc(/C=N/OCc2nn3c(n2)c2c(nc3)n(c(c2C)C)Cc2ccncc2)ccc1OC

STK621860
Synonyms: 1- cyclopropyl- N- (1,3- dihydroxy- 2- methylpropan- 2- yl)- 6,7- difluoro- 8- methoxy- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: OCC(NC(=O)c1cn(C2CC2)c2c(c1=O)cc(c(c2OC)F)F)(CO)C

STK621861
Synonyms: 3,3'- [(phenylimino)dimethanediyl]bis(2- hydroxy- 5,5- dimethyl- 3,5- dihydro- 4H- imidazol- 4- one)
Smiles: OC1=NC(C(=O)N1CN(c1ccccc1)CN1C(=NC(C1=O)(C)C)O)(C)C

STK621862
Synonyms: (2Z)- 6- (benzyloxy)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 1- benzofuran- 3(2H)- one
Smiles: Clc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OCc2ccccc2)c2c(c1)COCO2

STK621863
Synonyms: 5- bromo- N- (5- methyl- 1,3- thiazol- 2- yl)- 1- benzofuran- 2- carboxamide
Smiles: Brc1ccc2c(c1)cc(o2)C(=O)Nc1ncc(s1)C

STK856356
Synonyms: (2Z)- 2- [(6- bromo- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 6- (2- oxopropoxy)- 1- benzofuran- 3(2H)- one
Smiles: CC(=O)COc1ccc2c(c1)O/C(=C\c1cc(Br)cc3c1OCOC3)/C2=O

STK621865
Synonyms: (2Z)- 2- (3- methylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl(2E)- 3- phenylprop- 2- enoate
Smiles: O=C(Oc1ccc2c(c1)O/C(=C\c1cccc(c1)C)/C2=O)/C=C/c1ccccc1

STK621866
Synonyms: (2Z)- 8- (3- methoxybenzyl)- 2- (pyridin- 3- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cccc(c1)CN1COc2c(C1)c1O/C(=C\c3cccnc3)/C(=O)c1cc2

STK621868
Synonyms: {4- [(E)- (4- hydroxy- 1- methyl- 2,6- dioxo- 1,6- dihydropyrimidin- 5(2H)- ylidene)methyl]- 2- methoxyphenoxy}aceticacid
Smiles: COc1cc(ccc1OCC(=O)O)/C=C/1\C(=NC(=O)N(C1=O)C)O

STK621870
Synonyms: 3- (2- aminocyclohexyl)- 1,3- thiazolidine- 2,4- dione
Smiles: NC1CCCCC1N1C(=O)CSC1=O

STK621878
Synonyms: 7- {2- oxo- 2- [4- (pyridin- 2- yl)piperazin- 1- yl]ethoxy}- 2H- chromen- 2- one
Smiles: O=C(N1CCN(CC1)c1ccccn1)COc1ccc2c(c1)oc(=O)cc2

STK621882
Synonyms: N- (2- oxo- 1- propyl- 2,3- dihydro- 1H- indol- 3- yl)ethanediamide
Smiles: CCCN1C(=O)C(c2c1cccc2)NC(=O)C(=O)N

STK621885
Synonyms: N- (2- methoxyethyl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: COCCNC(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK621887
Synonyms: 5- (6- amino- 1,3- dimethyl- 2,4- dioxo- 1,2,3,4- tetrahydropyrimidin- 5- yl)- 6- (2,5- dichlorothiophen- 3- yl)- 1,3- dimethyl- 1H- pyrrolo[2,3- d]pyrimidine- 2,4(3H,7H)- dione
Smiles: Clc1sc(c(c1)c1[nH]c2c(c1c1c(N)n(C)c(=O)n(c1=O)C)c(=O)n(c(=O)n2C)C)Cl

STK621888
Synonyms: N- (3,4- dimethoxybenzyl)- 2- [(5- hydroxy- 4- oxo- 2- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: COc1cc(CNC(=O)COc2cc(O)c3c(c2)oc(cc3=O)c2ccccc2)ccc1OC

STK621889
Synonyms: N- [(2S)- 1- [(furan- 2- ylmethyl)amino]- 4- (methylsulfanyl)- 1- oxobutan- 2- yl]- 4- (1H- indol- 3- ylcarbonyl)piperazine- 1- carboxamide
Smiles: CSCC[C@@H](C(=O)NCc1ccco1)NC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2

STK621890
Synonyms: 5- [(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]furan- 2- carbaldehyde
Smiles: O=Cc1ccc(o1)Sc1nnnn1c1ccccc1

STK621891
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- N~3~- pyrimidin- 2- yl- beta- alaninamide
Smiles: O=C(CCNc1ncccn1)NCCc1c[nH]c2c1cc(Cl)cc2

STK621892
Synonyms: (2Z)- 2- [(5- bromo- 1- benzofuran- 2- yl)methylidene]- 4- methyl- 7- (morpholin- 4- ium- 4- ylmethyl)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: Brc1ccc2c(c1)cc(o2)/C=C/1\Oc2c(C1=O)c(C)cc(c2C[NH+]1CCOCC1)[O-]

STK621893
Synonyms: (2Z)- 2- [(5- methylfuran- 2- yl)methylidene]- 8- (pyridin- 4- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: Cc1ccc(o1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccncc1

STK621899
Synonyms: (6bS,9aR)- 3- bromo- 10- (2,2- dimethylpropanoyl)- 8- (prop- 2- en- 1- yl)- 9a,10- dihydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 7,9(6bH,8H)- dione
Smiles: C=CCN1C(=O)[C@H]2[C@@H](C1=O)C(N1C2C=Cc2c1ccc(c2)Br)C(=O)C(C)(C)C

STK621901
Synonyms: N- [(5E)- 5- (2H- chromen- 3- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- 3- hydroxybenzamide
Smiles: Oc1cccc(c1)C(=O)NN1C(=S)S/C(=C/C2=Cc3c(OC2)cccc3)/C1=O

STK621904
Synonyms: 2- (2- chlorophenyl)- 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- N,N- dimethyl- 1,3- oxazol- 5- amine
Smiles: CN(c1oc(nc1S(=O)(=O)c1ccc2c(c1)OCCO2)c1ccccc1Cl)C

STK621905
Synonyms: 2- [(4- methylpiperidin- 1- yl)methyl]quinazolin- 4- ol
Smiles: CC1CCN(CC1)Cc1nc(O)c2c(n1)cccc2

STK621906
Synonyms: (Z)- N- (5- ethyl- 1,3,4- thiadiazol- 2(3H)- ylidene)- 1- [(4- methoxyphenyl)sulfonyl]prolinamide
Smiles: CCc1n[nH]/c(=N/C(=O)C2CCCN2S(=O)(=O)c2ccc(cc2)OC)/s1

STK621908
Synonyms: 1- [3- (1H- indol- 3- yl)propanoyl]piperidine- 3- carboxylicacid
Smiles: OC(=O)C1CCCN(C1)C(=O)CCc1c[nH]c2c1cccc2

STK621910
Synonyms: 3- (2- chlorophenyl)- 5- phenyl- 3aH- pyrrolo[3,4- d][1,2]oxazole- 4,6(5H,6aH)- dione
Smiles: O=C1N(c2ccccc2)C(=O)C2C1ON=C2c1ccccc1Cl

STK621911
Synonyms: ethyl5- amino- 1- (3- hydroxyquinoxalin- 2- yl)- 1H- pyrazole- 4- carboxylate
Smiles: CCOC(=O)c1cnn(c1N)c1nc2ccccc2nc1O

STK621912
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- N- [3- (morpholin- 4- yl)propyl]- 2- phenyl- 1,3- oxazol- 5- amine
Smiles: O=S(=O)(c1nc(oc1NCCCN1CCOCC1)c1ccccc1)c1ccc2c(c1)OCCO2

STK621913
Synonyms: N- {[1- (phenylsulfonyl)piperidin- 3- yl]carbonyl}- L- alanine
Smiles: OC(=O)[C@@H](NC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1)C

STK621915
Synonyms: 2- [(5Z)- 5- (2,3- dimethoxybenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- [2- (4- hydroxyphenyl)ethyl]acetamide
Smiles: COc1cccc(c1OC)/C=C/1\SC(=O)N(C1=O)CC(=O)NCCc1ccc(cc1)O

STK621916
Synonyms: 2- (4- ethylpiperazin- 1- yl)- 6- [(pyrimidin- 2- ylsulfanyl)methyl]pyrimidin- 4- ol
Smiles: CCN1CCN(CC1)c1nc(CSc2ncccn2)cc(n1)O

STK621918
Synonyms: 1- (9H- purin- 6- yl)- N- (pyridin- 3- ylmethyl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)NCc1cccnc1

STK621920
Synonyms: 7- (4- methoxyphenyl)- 3- methyl- 4- (pyridin- 3- yl)- 4,6,7,8- tetrahydro[1,2]oxazolo[5,4- b]quinolin- 5- ol
Smiles: COc1ccc(cc1)C1CC(=C2C(=Nc3c(C2c2cccnc2)c(no3)C)C1)O

STK621925
Synonyms: 6- amino- 5- [6- (2,5- dimethylthiophen- 3- yl)- 4- hydroxy- 1- methyl- 2- oxo- 2,7- dihydro- 1H- pyrrolo[2,3- d]pyrimidin- 5- yl]- 1- methylpyrimidine- 2,4(1H,3H)- dione
Smiles: Cc1sc(c(c1)c1[nH]c2c(c1c1c(=O)[nH]c(=O)n(c1N)C)c(O)nc(=O)n2C)C

STK856362
Synonyms: methyl5- {[(2- methoxyphenyl)carbonyl]oxy}- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COC(=O)c1c(C)oc2c1cc(cc2)OC(=O)c1ccccc1OC

STK621926
Synonyms: (5E)- 1- (2,5- diethoxyphenyl)- 5- [(2E)- 3- (furan- 2- yl)prop- 2- en- 1- ylidene]- 2- hydroxypyrimidine- 4,6(1H,5H)- dione
Smiles: CCOc1ccc(cc1N1C(=NC(=O)/C(=C\C=C\c2ccco2)/C1=O)O)OCC

STK621927
Synonyms: (4E)- 5- (4- hydroxyphenyl)- 4- {hydroxy[4- (propan- 2- yloxy)phenyl]methylidene}- 1- [2- (morpholin- 4- yl)ethyl]pyrrolidine- 2,3- dione
Smiles: CC(Oc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)O)CCN1CCOCC1)/O)C

STK621929
Synonyms: N- {3- methyl- 1- [(4- methylphenyl)amino]- 1- oxobutan- 2- yl}piperidine- 4- carboxamide
Smiles: CC(C(C(=O)Nc1ccc(cc1)C)NC(=O)C1CCNCC1)C

STK621930
Synonyms: 2- methyl- 3- [2- (3- phenyl- 1,2,4- oxadiazol- 5- yl)ethyl]quinazolin- 4(3H)- one
Smiles: Cc1nc2ccccc2c(=O)n1CCc1onc(n1)c1ccccc1

STK621932
Synonyms: 4- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)butanehydrazide
Smiles: NNC(=O)CCCn1c(O)nc2c(c1=O)cccc2

STK621933
Synonyms: 3- [3- (4- benzylpiperazin- 1- yl)- 3- oxopropyl]- 7- methoxy- 4- methyl- 2H- chromen- 2- one
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCN(CC1)Cc1ccccc1

STK856363
Synonyms: 3- (3- methoxyphenoxy)- 9- (pyridin- 4- ylmethyl)- 2- (trifluoromethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1cccc(c1)Oc1c(=O)c2ccc3c(c2oc1C(F)(F)F)CN(CO3)Cc1ccncc1

STK621945
Synonyms: 8,9- dimethyl- 7- (6- methylpyridin- 2- yl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Cc1cccc(n1)n1c(C)c(c2c1ncn1c2ncn1)C

STK621947
Synonyms: 1- (4- hydroxyphenyl)- 5- imino- 4- (4- phenyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Oc1ccc(cc1)N1CC(=C(C1=N)c1scc(n1)c1ccccc1)O

STK621948
Synonyms: (3Z)- 3- (3- hydroxybenzylidene)- 2,3- dihydro- 4H- 1,2- benzothiazin- 4- one1,1- dioxide
Smiles: Oc1cccc(c1)/C=C/1\NS(=O)(=O)c2c(C1=O)cccc2

STK621949
Synonyms: 2- (4- chlorophenyl)- 2- (pyrrolidin- 1- yl)ethanamine
Smiles: NCC(c1ccc(cc1)Cl)N1CCCC1

STK621952
Synonyms: 5- (biphenyl- 4- yl)- 2- hydroxy- 1- propylpyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: CCCn1c(O)nc(=O)c2c1nccc2c1ccc(cc1)c1ccccc1

STK621953
Synonyms: 8- {2- [(3- chlorophenyl)amino]ethyl}- 4- hydroxy- 1,7- dimethyl- 1H- imidazo[2,1- f]purin- 2(8H)- one
Smiles: Clc1cccc(c1)NCCn1c(C)cn2c1nc1c2c(O)nc(=O)n1C

STK621954
Synonyms: methyl3- [(E)- (3- benzyl- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene)methyl]- 5- fluoro- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1/C=C\1/SC(=S)N(C1=O)Cc1ccccc1)cc(cc2)F

STK621959
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)N1CCC(CC1)c1nc2c(s1)cccc2)C

STK621960
Synonyms: 2- (4- hydroxyphthalazin- 1- yl)- 1- {4- [2- (pyridin- 4- yl)ethyl]piperazin- 1- yl}ethanone
Smiles: O=C(N1CCN(CC1)CCc1ccncc1)Cc1nnc(c2c1cccc2)O

STK621963
Synonyms: benzyl({(2E)- 2- [(1- ethyl- 5- methoxy- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl}oxy)acetate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OCC(=O)OCc1ccccc1)cn2CC

STK621964
Synonyms: 7- (5- bromopyridin- 2- yl)- 3- butyl- 5,6- dimethyl- 3,7- dihydro- 4H- pyrrolo[2,3- d]pyrimidin- 4- imine
Smiles: CCCCn1cnc2c(c1=N)c(C)c(n2c1ccc(cn1)Br)C

STK621965
Synonyms: 6,7- dimethoxy- N- {2- [(3- methoxypropyl)carbamoyl]phenyl}- 3,4- dihydroisoquinoline- 2(1H)- carboxamide
Smiles: COCCCNC(=O)c1ccccc1NC(=O)N1CCc2c(C1)cc(c(c2)OC)OC

STK621970
Synonyms: ethyl2- [4- (diphenylmethyl)piperazin- 1- yl]- 4- hydroxypyrimidine- 5- carboxylate
Smiles: CCOC(=O)c1cnc(nc1O)N1CCN(CC1)C(c1ccccc1)c1ccccc1

STK621973
Synonyms: 2- (7H- purin- 6- ylsulfanyl)- N- (3,4,5- trimethoxyphenyl)propanamide
Smiles: COc1cc(NC(=O)C(Sc2ncnc3c2[nH]cn3)C)cc(c1OC)OC

STK856367
Synonyms: [3- (4- ethylphenyl)- 5- (quinoxalin- 6- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl](furan- 2- yl)methanone
Smiles: CCc1ccc(cc1)C1=NN(C(C1)c1ccc2c(c1)nccn2)C(=O)c1ccco1

STK621975
Synonyms: 3- (3- methoxyphenoxy)- 9- (tetrahydrofuran- 2- ylmethyl)- 2- (trifluoromethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1cccc(c1)Oc1c(=O)c2ccc3c(c2oc1C(F)(F)F)CN(CO3)CC1CCCO1

STK621976
Synonyms: 2- [(5Z)- 5- (furan- 2- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- (quinoxalin- 6- yl)acetamide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccco2)/C1=O)Nc1ccc2c(c1)nccn2

STK621980
Synonyms: 4- ({[4- (1,3- benzoxazol- 2- yl)piperidin- 1- yl]carbonyl}amino)butanoicacid
Smiles: OC(=O)CCCNC(=O)N1CCC(CC1)c1nc2c(o1)cccc2

STK621983
Synonyms: 3- phenyl- 9- (pyridin- 4- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: O=c1c(coc2c1ccc1c2CN(CO1)Cc1ccncc1)c1ccccc1

STK621985
Synonyms: N- {(5Z)- 5- [(1- methyl- 1,2,3,4- tetrahydroquinolin- 6- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}acetamide
Smiles: CC(=O)NN1C(=S)S/C(=C\c2ccc3c(c2)CCCN3C)/C1=O

STK621987
Synonyms: 2- [3- (2,4- dimethoxyphenyl)- 1,2,4- oxadiazol- 5- yl]pyrazine
Smiles: COc1cc(OC)ccc1c1noc(n1)c1cnccn1

STK621990
Synonyms: 2- {6- [(2,4- dichlorophenoxy)methyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 3- yl}- 1H- indole
Smiles: Clc1ccc(c(c1)Cl)OCc1nn2c(s1)nnc2c1cc2c([nH]1)cccc2

STK621991
Synonyms: 3- methyl- 4- oxo- 2- phenyl- N- (propan- 2- yl)- 4H- chromene- 8- carboxamide
Smiles: CC(NC(=O)c1cccc2c1oc(c1ccccc1)c(c2=O)C)C

STK621992
Synonyms: N- [2- (1H- imidazol- 5- yl)ethyl]- 2- (6'- methyl- 8'- oxo- 3',4'- dihydro- 8'H- spiro[cyclohexane- 1,2'- pyrano[3,2- g]chromen]- 7'- yl)acetamide
Smiles: O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)OC2(CC1)CCCCC2)NCCc1[nH]cnc1

STK621993
Synonyms: 1- (4,6- dimethylpyrimidin- 2- yl)- 4- {2- [(3- fluorobenzyl)oxy]phenyl}- 3- methyl- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: Fc1cccc(c1)COc1ccccc1C1CC(=Nc2c1c(C)nn2c1nc(C)cc(n1)C)O

STK621994
Synonyms: 2- [2- (3,4- dimethoxyphenyl)- 1,3- thiazol- 4- yl]- 1- (4- hydroxypiperidin- 1- yl)ethanone
Smiles: COc1cc(ccc1OC)c1scc(n1)CC(=O)N1CCC(CC1)O

STK621998
Synonyms: (2Z)- 2- (biphenyl- 4- ylmethylidene)- 6- {[(2E)- 3- phenylprop- 2- en- 1- yl]oxy}- 1- benzofuran- 3(2H)- one
Smiles: O=C1/C(=C/c2ccc(cc2)c2ccccc2)/Oc2c1ccc(c2)OC/C=C/c1ccccc1

STK856371
Synonyms: ethyl{[(2Z)- 2- (2,4- dichlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: CCOC(=O)COc1ccc2c(c1)O/C(=C\c1ccc(cc1Cl)Cl)/C2=O

STK622001
Synonyms: 2- [(5E)- 4- oxo- 5- (quinolin- 6- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]- 3- phenylpropanoicacid
Smiles: OC(=O)C(N1C(=S)S/C(=C/c2ccc3c(c2)cccn3)/C1=O)Cc1ccccc1

STK856372
Synonyms: ethyl2- hydroxy- 4- (pyridin- 3- yl)- 3,4- dihydropyrimido[1,2- a]benzimidazole- 3- carboxylate
Smiles: CCOC(=O)C1C(=Nc2n(C1c1cccnc1)c1ccccc1n2)O

STK622006
Synonyms: 6- amino- 4- hydroxy- 1- (4- methoxyphenyl)- 2- oxo- 1,2- dihydropyrimidine- 5- carbaldehyde
Smiles: COc1ccc(cc1)n1c(=O)nc(c(c1N)C=O)O

STK622008
Synonyms: N- cycloheptyl- 2- [(9- oxo- 1,2,3,9- tetrahydropyrrolo[2,1- b]quinazolin- 7- yl)oxy]acetamide
Smiles: O=C(NC1CCCCCC1)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK622009
Synonyms: 2- (2,3- dihydro- 1H- indol- 1- yl)- 4'- methyl- 2'- (piperidin- 1- yl)- 4,5'- bipyrimidin- 6- ol
Smiles: Oc1nc(nc(c1)c1cnc(nc1C)N1CCCCC1)N1CCc2c1cccc2

STK622010
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- N- [3- (1H- imidazol- 1- yl)propyl]- 2- (4- methoxyphenyl)- 1,3- oxazol- 5- amine
Smiles: COc1ccc(cc1)c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NCCCn1ccnc1

STK622011
Synonyms: (1Z)- 1- (3,4- dimethoxyphenyl)- N- {[8,9- dimethyl- 7- (2- methylpropyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl]methoxy}ethanimine
Smiles: COc1cc(ccc1OC)/C(=N\OCc1nn2c(n1)c1c(nc2)n(c(c1C)C)CC(C)C)/C

STK622012
Synonyms: (4- benzylpiperidin- 1- yl)(1H- indol- 2- yl)methanone
Smiles: O=C(c1cc2c([nH]1)cccc2)N1CCC(CC1)Cc1ccccc1

STK856373
Synonyms: 3- (3- methoxyphenoxy)- 2- methyl- 4- oxo- 4H- chromen- 7- yldimethylcarbamate
Smiles: COc1cccc(c1)Oc1c(C)oc2c(c1=O)ccc(c2)OC(=O)N(C)C

STK622014
Synonyms: N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)- 3- {(5Z)- 4- oxo- 5- [(2E)- 3- phenylprop- 2- en- 1- ylidene]- 2- thioxo- 1,3- thiazolidin- 3- yl}propanamide
Smiles: O=C(NC1C=CS(=O)(=O)C1)CCN1C(=S)S/C(=C\C=C\c2ccccc2)/C1=O

STK622015
Synonyms: N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- 1- benzofuran- 2- carboxamide
Smiles: Fc1ccc2c(c1)c(CCNC(=O)c1cc3c(o1)cccc3)c[nH]2

STK622016
Synonyms: 7- (3- methoxyphenyl)- 8,9- dimethyl- 2- (pyridin- 4- yl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: COc1cccc(c1)n1c(C)c(c2c1ncn1c2nc(n1)c1ccncc1)C

STK856374
Synonyms: methyl6- bromo- 4- formyl- 5- hydroxy- 2- methyl- 1- benzofuran- 3- carboxylate
Smiles: COC(=O)c1c(C)oc2c1c(C=O)c(c(c2)Br)O

STK622017
Synonyms: 2- (4- chlorophenyl)- 5- phenyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Clc1ccc(cc1)n1[nH]c(cc1=O)c1ccccc1

STK856375
Synonyms: ethyl{[(2Z)- 3- oxo- 2- (thiophen- 2- ylmethylidene)- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: CCOC(=O)COc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O

STK622019
Synonyms: 3- (2- ethoxyphenoxy)- 7- [2- (3- methylpiperidin- 1- yl)- 2- oxoethoxy]- 4H- chromen- 4- one
Smiles: CCOc1ccccc1Oc1coc2c(c1=O)ccc(c2)OCC(=O)N1CCCC(C1)C

STK622020
Synonyms: 3- (4- chlorophenyl)- 4- (2,5- difluorophenyl)- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: Clc1ccc(cc1)c1n[nH]c2c1C(CC(=N2)O)c1cc(F)ccc1F

STK622021
Synonyms: (2Z)- 2- (4- chlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yldiphenylcarbamate
Smiles: Clc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)N(c1ccccc1)c1ccccc1

STK622028
Synonyms: N- [2- (1,3- benzodioxol- 5- ylamino)- 2- oxoethyl]- 3- phenyl- 2,1- benzoxazole- 5- carboxamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CNC(=O)c1ccc2c(c1)c(on2)c1ccccc1

STK622029
Synonyms: [3- (furan- 2- yl)- 5- (quinoxalin- 6- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl](4- methoxyphenyl)methanone
Smiles: COc1ccc(cc1)C(=O)N1N=C(CC1c1ccc2c(c1)nccn2)c1ccco1

STK622031
Synonyms: ethyl4- (2,4- dimethoxyphenyl)- 2- (4- methylpiperazin- 1- yl)- 6- oxo- 1,4,5,6- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=NC1c1ccc(cc1OC)OC)N1CCN(CC1)C

STK622037
Synonyms: 1- (1- ethyl- 1H- indol- 3- yl)propan- 2- amine
Smiles: CCn1cc(c2c1cccc2)CC(N)C

STK622038
Synonyms: 2- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)- N- [2- (5- methoxy- 1H- indol- 3- yl)ethyl]acetamide
Smiles: COc1ccc2c(c1)c(CCNC(=O)Cc1nn3c(n1)nc(cc3O)C)c[nH]2

STK622040
Synonyms: 4- [5- (1,3- benzodioxol- 5- yl)- 3- (6- chloro- 2- methyl- 4- phenylquinolin- 3- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc2c(c1)OCO2)c1c(C)nc2c(c1c1ccccc1)cc(cc2)Cl

STK622042
Synonyms: ethyl(5,5- dioxido- 3- phenyl- 2- thioxohexahydro- 1H- thieno[3,4- d]imidazol- 1- yl)acetate
Smiles: CCOC(=O)CN1C2CS(=O)(=O)CC2N(C1=S)c1ccccc1

STK622043
Synonyms: N- [4- (3- ethyl- 2- hydroxy- 6- oxo- 3,4,5,6- tetrahydropyridin- 3- yl)phenyl]- 3,4,5- trimethoxybenzamide
Smiles: CCC1(CCC(=O)N=C1O)c1ccc(cc1)NC(=O)c1cc(OC)c(c(c1)OC)OC

STK622045
Synonyms: {(3E)- 3- [hydroxy(4- methoxyphenyl)methylidene]- 4,5- dioxo- 2- phenylpyrrolidin- 1- yl}aceticacid
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CC(=O)O)/O

STK622047
Synonyms: benzyl{[(2Z)- 2- (2,6- dichlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: O=C(OCc1ccccc1)COc1ccc2c(c1)O/C(=C\c1c(Cl)cccc1Cl)/C2=O

STK622049
Synonyms: (2Z)- 2- [(5- methylfuran- 2- yl)methylidene]- 8- (tetrahydrofuran- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: Cc1ccc(o1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)CC1CCCO1

STK622053
Synonyms: N- [1- methyl- 2- oxo- 3- (2- oxo- 2- phenylethyl)- 2,3- dihydro- 1H- indol- 3- yl]acetamide
Smiles: CC(=O)NC1(CC(=O)c2ccccc2)c2ccccc2N(C1=O)C

STK622055
Synonyms: 2- ({[2- methyl- 4- (4- methyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)phenyl]sulfonyl}amino)benzamide
Smiles: O=C1C(C)CS(=O)(=O)N1c1ccc(c(c1)C)S(=O)(=O)Nc1ccccc1C(=O)N

STK622057
Synonyms: 2- (1,3- benzodioxol- 5- yl)- 2- (1H- indol- 3- yl)ethanamine
Smiles: NCC(c1c[nH]c2c1cccc2)c1ccc2c(c1)OCO2

STK622059
Synonyms: 1- ({[3- (4- methoxyphenyl)- 4- oxo- 4H- chromen- 7- yl]oxy}acetyl)piperidin- 4- one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCC(=O)N1CCC(=O)CC1

STK622061
Synonyms: 1- {[4- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- 2- methylphenyl]sulfonyl}piperidine- 4- carboxamide
Smiles: NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1C)N1C(=O)C(CS1(=O)=O)(C)C

STK622064
Synonyms: 3- hydroxy- N- {1- [(4- methylphenyl)amino]- 1- oxo- 3- phenylpropan- 2- yl}quinoxaline- 1(2H)- carboxamide
Smiles: O=C(C(NC(=O)N1CC(=Nc2c1cccc2)O)Cc1ccccc1)Nc1ccc(cc1)C

STK622065
Synonyms: 4- nitro- N- [2- (2- oxo- 2,6,7,8- tetrahydrocyclopenta[g]chromen- 4- yl)- 1- benzofuran- 3- yl]benzamide
Smiles: O=c1oc2cc3CCCc3cc2c(c1)c1oc2c(c1NC(=O)c1ccc(cc1)[N+](=O)[O-])cccc2

STK622066
Synonyms: 4- ({[(5Z)- 5- (3- fluorobenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]acetyl}amino)- 2- hydroxybenzoicacid
Smiles: O=C(CN1C(=O)S/C(=C\c2cccc(c2)F)/C1=O)Nc1ccc(c(c1)O)C(=O)O

STK622067
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzoate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OC(=O)c1ccc(cc1)Cl)cn2C

STK622070
Synonyms: N- (2- {[(1S)- 2- hydroxy- 1- phenylethyl]amino}- 2- oxoethyl)- 1- (phenylsulfonyl)piperidine- 3- carboxamide
Smiles: OC[C@H](c1ccccc1)NC(=O)CNC(=O)C1CCCN(C1)S(=O)(=O)c1ccccc1

STK856377
Synonyms: methyl4- ({4- oxo- 9- [2- (thiophen- 2- yl)ethyl]- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 3- yl}oxy)benzoate
Smiles: COC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc1c2CN(CO1)CCc1cccs1

STK622073
Synonyms: N- (2- cyanoethyl)- 2- (5- methoxy- 4,8,8- trimethyl- 2- oxo- 9,10- dihydro- 2H,8H- pyrano[2,3- f]chromen- 3- yl)- N- methylacetamide
Smiles: N#CCCN(C(=O)Cc1c(=O)oc2c(c1C)c(OC)cc1c2CCC(O1)(C)C)C

STK622074
Synonyms: N- [2- (2,3- dihydro- 1H- inden- 2- ylcarbamoyl)phenyl]- N'- (2- hydroxyethyl)ethanediamide
Smiles: OCCNC(=O)C(=O)Nc1ccccc1C(=O)NC1Cc2c(C1)cccc2

STK622075
Synonyms: benzyl{[(2Z)- 2- (4- tert- butylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: O=C(OCc1ccccc1)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(C)(C)C)/C2=O

STK622078
Synonyms: (2Z)- 8- (furan- 2- ylmethyl)- 2- (2,4,5- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(OC)c(cc1/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccco1)OC

STK622079
Synonyms: 2- [(5E)- 5- (3- chlorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [2- (dimethylamino)ethyl]acetamide
Smiles: CN(CCNC(=O)CN1C(=S)S/C(=C/c2cccc(c2)Cl)/C1=O)C

STK622080
Synonyms: N- (3,4- dichlorophenyl)- 3- {(4S)- 2,5- dioxo- 1- [(1S)- 1- phenylethyl]imidazolidin- 4- yl}propanamide
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CC[C@@H]1NC(=O)N(C1=O)[C@H](c1ccccc1)C

STK622081
Synonyms: 1- [2- (2,4- dichlorophenyl)ethyl]- 5- imino- 4- [4- (4- methoxyphenyl)- 1,3- thiazol- 2- yl]- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: COc1ccc(cc1)c1csc(n1)C1=C(O)CN(C1=N)CCc1ccc(cc1Cl)Cl

STK622082
Synonyms: N- [1- (2,3- dimethylphenyl)- 2- hydroxy- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]cyclohexanecarboxamide
Smiles: O=C(C1CCCCC1)NC1(N=C(N(C1=O)c1cccc(c1C)C)O)C(F)(F)F

STK622085
Synonyms: N- (2,3- dihydroxypropyl)- 2- [(5- hydroxy- 4- oxo- 2- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: OCC(CNC(=O)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1)O

STK622087
Synonyms: 3- (4- methoxyphenyl)- 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1ccc(cc1)c1nnc2n1nc(s2)c1n[nH]c(c1)CC(C)C

STK622088
Synonyms: 4- (1H- indol- 3- ylcarbonyl)- N- [(2S)- 4- (methylsulfanyl)- 1- oxo- 1- (1,3- thiazol- 2- ylamino)butan- 2- yl]piperazine- 1- carboxamide
Smiles: CSCC[C@@H](C(=O)Nc1nccs1)NC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2

STK622090
Synonyms: N,N- dimethyl- N'- (11- methyl- 8,9,10,11- tetrahydro[1]benzothieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 5- yl)propane- 1,3- diamine
Smiles: CN(CCCNc1nc2sc3c(c2c2n1ncn2)C(C)CCC3)C

STK622092
Synonyms: 6- benzyl- 3- (pyridin- 3- ylamino)- 1,2,4- triazin- 5- ol
Smiles: Oc1nc(nnc1Cc1ccccc1)Nc1cccnc1

STK622096
Synonyms: N- [3- (acetylamino)phenyl]- N~2~- [(4- hydroxyphthalazin- 1- yl)acetyl]glycinamide
Smiles: O=C(Nc1cccc(c1)NC(=O)C)CNC(=O)Cc1nnc(c2c1cccc2)O

STK622097
Synonyms: N- (2- chlorobenzyl)- 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]propanamide
Smiles: O=C(NCc1ccccc1Cl)CCSc1nc(Cl)nc2c1[nH]cn2

STK856381
Synonyms: (2Z)- 2- (2,3- dimethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzenesulfonate
Smiles: COc1cccc(c1OC)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)F

STK856382
Synonyms: ethyl{[(2Z)- 2- (2- methylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}acetate
Smiles: CCOC(=O)COc1ccc2c(c1)O/C(=C\c1ccccc1C)/C2=O

STK622101
Synonyms: N- (2- {[2- (5- fluoro- 1H- indol- 3- yl)ethyl]amino}- 2- oxoethyl)- 3- phenyl- 2,1- benzoxazole- 5- carboxamide
Smiles: O=C(CNC(=O)c1ccc2c(c1)c(on2)c1ccccc1)NCCc1c[nH]c2c1cc(F)cc2

STK622102
Synonyms: (2Z)- 2- (2- methoxybenzylidene)- 8- (pyridin- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccccc1/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccccn1

STK622108
Synonyms: 1- (pyrimidin- 2- yl)- N- (3,4,5- trimethoxyphenyl)piperidine- 3- carboxamide
Smiles: COc1cc(NC(=O)C2CCCN(C2)c2ncccn2)cc(c1OC)OC

STK622110
Synonyms: N- [(3- phenyl- 1,2,4- oxadiazol- 5- yl)methyl]- 1- (7H- purin- 6- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ncnc2c1[nH]cn2)NCc1onc(n1)c1ccccc1

STK622113
Synonyms: 5- amino- N- (3- bromophenyl)- 1- (4- fluorophenyl)- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: Fc1ccc(cc1)n1nnc(c1N)C(=O)Nc1cccc(c1)Br

STK622114
Synonyms: 2,5,6- trihydroxy- 5- (8- hydroxyquinolin- 7- yl)pyrimidin- 4(5H)- one
Smiles: OC1=NC(=O)C(C(=N1)O)(O)c1ccc2c(c1O)nccc2

STK622116
Synonyms: 5- benzyl- 4- (pyridin- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: S=c1[nH]nc(n1c1cccnc1)Cc1ccccc1

STK622118
Synonyms: 1- (9H- purin- 6- yl)- N- (pyridin- 2- ylmethyl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)NCc1ccccn1

STK622119
Synonyms: 6- (5- bromopyridin- 3- yl)- 3- (furan- 2- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Brc1cncc(c1)c1nn2c(s1)nnc2c1ccco1

STK622120
Synonyms: N- [2- hydroxy- 1- methyl- 5- oxo- 4- (trifluoromethyl)- 4,5- dihydro- 1H- imidazol- 4- yl]benzamide
Smiles: CN1C(=NC(C1=O)(NC(=O)c1ccccc1)C(F)(F)F)O

STK622123
Synonyms: methyl{2- [4- (4- fluorophenyl)piperazin- 1- yl]- 6- hydroxypyrimidin- 4- yl}acetate
Smiles: COC(=O)Cc1cc(O)nc(n1)N1CCN(CC1)c1ccc(cc1)F

STK622127
Synonyms: 1- benzyl- 5- (4- fluorophenyl)- 2- hydroxypyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Fc1ccc(cc1)c1ccnc2c1c(=O)nc(n2Cc1ccccc1)O

STK622128
Synonyms: 1- (2- {[(4,6- dimethylpyrimidin- 2- yl)sulfanyl]methyl}- 1- methyl- 1H- benzimidazol- 5- yl)- 3- phenylurea
Smiles: O=C(Nc1ccccc1)Nc1ccc2c(c1)nc(n2C)CSc1nc(C)cc(n1)C

STK622130
Synonyms: (5Z)- 5- (3,4- dimethoxybenzylidene)- 3- {2- [2- (2- hydroxyethyl)piperidin- 1- yl]- 2- oxoethyl}- 1,3- thiazolidine- 2,4- dione
Smiles: OCCC1CCCCN1C(=O)CN1C(=O)S/C(=C\c2ccc(c(c2)OC)OC)/C1=O

STK622131
Synonyms: 2,6- dichloro- N- {2- [(4- methoxyphenyl)carbonyl]- 3- methyl- 1- benzofuran- 5- yl}pyridine- 3- carboxamide
Smiles: COc1ccc(cc1)C(=O)c1oc2c(c1C)cc(cc2)NC(=O)c1ccc(nc1Cl)Cl

STK856384
Synonyms: 2- methoxyethyl6- bromo- 2- methyl- 5- [(2- methylprop- 2- en- 1- yl)oxy]- 1- benzofuran- 3- carboxylate
Smiles: COCCOC(=O)c1c(C)oc2c1cc(OCC(=C)C)c(c2)Br

STK622134
Synonyms: N- (2- fluorophenyl)- 2- [(5- hydroxy- 4- oxo- 2- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: O=C(Nc1ccccc1F)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1

STK622135
Synonyms: N- (2,3- dihydro- 1H- inden- 2- yl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)sc(n2)n1cccc1)NC1Cc2c(C1)cccc2

STK622139
Synonyms: (5Z)- 5- (2,5- dimethoxybenzylidene)- 3- {2- [2- (2- hydroxyethyl)piperidin- 1- yl]- 2- oxoethyl}- 1,3- thiazolidine- 2,4- dione
Smiles: OCCC1CCCCN1C(=O)CN1C(=O)S/C(=C\c2cc(OC)ccc2OC)/C1=O

STK856385
Synonyms: 3- (2- methoxyphenyl)- 9- (thiophen- 2- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccccc1c1coc2c(c1=O)ccc1c2CN(CO1)Cc1cccs1

STK622142
Synonyms: ethyl3- (4- hydroxy- 2- methylpyrimido[1,2- a]benzimidazol- 3- yl)propanoate
Smiles: CCOC(=O)CCc1c(C)nc2n(c1O)c1ccccc1n2

STK622143
Synonyms: 5,6- dimethyl- 7- (4- methylpyridin- 2- yl)- 3- (pyridin- 3- ylmethyl)- 3,7- dihydro- 4H- pyrrolo[2,3- d]pyrimidin- 4- imine
Smiles: Cc1ccnc(c1)n1c(C)c(c2c1ncn(c2=N)Cc1cccnc1)C

STK622144
Synonyms: N- {2- oxo- 2- [(thiophen- 2- ylmethyl)amino]ethyl}- 1- (phenylsulfonyl)piperidine- 4- carboxamide
Smiles: O=C(NCc1cccs1)CNC(=O)C1CCN(CC1)S(=O)(=O)c1ccccc1

STK622146
Synonyms: 3- (2,4- dichlorophenyl)- 6- (pyridin- 4- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Clc1ccc(c(c1)Cl)c1nnc2n1nc(s2)c1ccncc1

STK622147
Synonyms: N- [(2S)- 1- hydroxy- 4- (methylsulfanyl)butan- 2- yl]- 2- [(4- oxo- 3,4- dihydrospiro[chromene- 2,1'- cyclohexan]- 7- yl)oxy]acetamide
Smiles: CSCC[C@H](NC(=O)COc1ccc2c(c1)OC1(CC2=O)CCCCC1)CO

STK622152
Synonyms: 3- (2- chlorophenyl)- 1- methyl- 1- [(5- oxo- 2,3- dihydro- 1H,5H- pyrido[3,2,1- ij]quinolin- 6- yl)methyl]thiourea
Smiles: CN(C(=S)Nc1ccccc1Cl)Cc1cc2cccc3c2n(c1=O)CCC3

STK622154
Synonyms: 2- {[3- (3,4- dimethoxyphenyl)- 2- oxo- 2H- chromen- 7- yl]oxy}- N- (5- methyl- 1,3- thiazol- 2- yl)acetamide
Smiles: COc1cc(ccc1OC)c1cc2ccc(cc2oc1=O)OCC(=O)Nc1ncc(s1)C

STK622155
Synonyms: 4- (3- chlorophenyl)- 2- (2,3- dihydro- 1H- indol- 1- yl)- 8- methyl- 4,9- dihydro- 6H- pyrimido[1,2- a][1,3,5]triazin- 6- one
Smiles: Clc1cccc(c1)C1N=C(N=c2n1c(=O)cc([nH]2)C)N1CCc2c1cccc2

STK622160
Synonyms: (3E)- 1- benzyl- 3- (3,4- dihydroxybenzylidene)pyrrolidine- 2,5- dione
Smiles: O=C1C/C(=C\c2ccc(c(c2)O)O)/C(=O)N1Cc1ccccc1

STK622162
Synonyms: N- (1- benzylpiperidin- 4- yl)- 2- [2- (3,4- dimethoxyphenyl)- 1,3- thiazol- 4- yl]acetamide
Smiles: COc1cc(ccc1OC)c1scc(n1)CC(=O)NC1CCN(CC1)Cc1ccccc1

STK622163
Synonyms: 7- methyl- 4- oxo- N- [4- (5,6,7,8- tetrahydronaphthalen- 2- yl)- 1,2,5- oxadiazol- 3- yl]- 4H- chromene- 2- carboxamide
Smiles: Cc1ccc2c(c1)oc(cc2=O)C(=O)Nc1nonc1c1ccc2c(c1)CCCC2

STK622164
Synonyms: 6- fluoro- 2- [(methylamino)methyl]quinazolin- 4- ol
Smiles: CNCc1nc(O)c2c(n1)ccc(c2)F

STK622165
Synonyms: 7- [2- (dimethylamino)ethyl]- 5,6- dimethyl- N- (pyridin- 4- ylmethyl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: CN(CCn1c(C)c(c2c1ncnc2NCc1ccncc1)C)C

STK622167
Synonyms: 3- (4- chlorophenyl)- 9- (pyridin- 3- yl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: Clc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CO1)c1cccnc1

STK856387
Synonyms: (2Z)- 2- (3,4- dichlorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylmethanesulfonate
Smiles: O=C1/C(=C/c2ccc(c(c2)Cl)Cl)/Oc2c1ccc(c2)OS(=O)(=O)C

STK622171
Synonyms: 3- (3- chlorophenyl)- 6- [2- (3,4- dimethoxyphenyl)ethyl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1cc(CCc2nn3c(s2)nnc3c2cccc(c2)Cl)ccc1OC

STK622172
Synonyms: N- (3- {[4- (3- chlorophenyl)piperazin- 1- yl]methyl}- 1- ethyl- 2- oxo- 2,3- dihydro- 1H- indol- 3- yl)acetamide
Smiles: CCN1c2ccccc2C(C1=O)(CN1CCN(CC1)c1cccc(c1)Cl)NC(=O)C

STK622173
Synonyms: 2- [4- (8,9- dimethylthieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 5- yl)piperazin- 1- yl]- N- (tetrahydrofuran- 2- ylmethyl)acetamide
Smiles: O=C(CN1CCN(CC1)c1nc2sc(c(c2c2n1ncn2)C)C)NCC1CCCO1

STK622177
Synonyms: 3- (4- methoxyphenyl)- 9- (pyridin- 4- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc1c2CN(CO1)Cc1ccncc1

STK856388
Synonyms: 2- (4- methylphenyl)- 5- {[(1- phenyl- 1H- tetrazol- 5- yl)sulfanyl]methyl}- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: Cc1ccc(cc1)n1[nH]c(cc1=O)CSc1nnnn1c1ccccc1

STK622179
Synonyms: 4'- tert- butyl- 7- methyl- 3,4- dihydro- 2H- spiro[benzo[c]pyrano[3,2- g]chromene- 9,1'- cyclohexane]- 5,11(1H,10H)- dione
Smiles: O=C1CC2(CCC(CC2)C(C)(C)C)Oc2c1cc1c(c2C)oc(=O)c2c1CCCC2

STK622180
Synonyms: 2- chloro- 5- [3- (3- cyclopropyl- 1H- pyrazol- 5- yl)- 5- thioxo- 1,5- dihydro- 4H- 1,2,4- triazol- 4- yl]benzoicacid
Smiles: OC(=O)c1cc(ccc1Cl)n1c(=S)[nH]nc1c1[nH]nc(c1)C1CC1

STK622182
Synonyms: 3- [(5E)- 5- (3- fluorobenzylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- [2- (1H- indol- 3- yl)ethyl]propanamide
Smiles: O=C(CCN1C(=O)S/C(=C/c2cccc(c2)F)/C1=O)NCCc1c[nH]c2c1cccc2

STK622183
Synonyms: N- (2- methylcyclohexyl)- 2- [(9- oxo- 1,2,3,9- tetrahydropyrrolo[2,1- b]quinazolin- 7- yl)oxy]acetamide
Smiles: O=C(NC1CCCCC1C)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK622186
Synonyms: {7- [(3,4- dichlorobenzyl)oxy]- 4- methyl- 2- oxo- 2H- chromen- 3- yl}aceticacid
Smiles: OC(=O)Cc1c(=O)oc2c(c1C)ccc(c2)OCc1ccc(c(c1)Cl)Cl

STK622188
Synonyms: 3- cyclohexyl- 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2C1CCCCC1)C

STK622190
Synonyms: cyclohexyl[4- (1H- indol- 3- ylcarbonyl)piperazin- 1- yl]methanone
Smiles: O=C(N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2)C1CCCCC1

STK622193
Synonyms: 5- (2,5- difluorophenyl)- 4- (2,5- dimethoxyphenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: COc1ccc(cc1n1c(=S)[nH]nc1c1cc(F)ccc1F)OC

STK622195
Synonyms: tert- butyl[1- ({[(8'E)- 6'- butyl- 3',4'- dihydro- 8'H- spiro[cyclohexane- 1,2'- pyrano[3,2- g]chromen]- 8'- ylidene]amino}oxy)- 1- oxobutan- 2- yl]carbamate
Smiles: CCCCc1c/c(=N\OC(=O)C(NC(=O)OC(C)(C)C)CC)/oc2c1cc1CCC3(Oc1c2)CCCCC3

STK622196
Synonyms: 7- (4- fluorophenyl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Fc1ccc(cc1)n1c(C)c(c2c1ncn1c2ncn1)C

STK622199
Synonyms: (2E)- 4- {[2- (methylsulfamoyl)ethyl](pyridin- 4- ylmethyl)amino}- 4- oxobut- 2- enoicacid
Smiles: CNS(=O)(=O)CCN(C(=O)/C=C/C(=O)O)Cc1ccncc1

STK856390
Synonyms: 2- [(4- fluorobenzyl)sulfanyl]- 6- methyl- 4- (trifluoromethyl)pyridine- 3- carbonitrile
Smiles: N#Cc1c(SCc2ccc(cc2)F)nc(cc1C(F)(F)F)C

STK622204
Synonyms: (2Z)- 2- (5- bromo- 2- methoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylbenzenesulfonate
Smiles: COc1ccc(cc1/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccccc1)Br

STK622205
Synonyms: N- [2- (azepan- 1- ylsulfonyl)ethyl]- 2- ethoxy- N- (pyridin- 2- ylmethyl)pyridine- 3- carboxamide
Smiles: CCOc1ncccc1C(=O)N(Cc1ccccn1)CCS(=O)(=O)N1CCCCCC1

STK622208
Synonyms: 5- methyl- 7,9- dioxo- N- phenyl- 8- (tetrahydrofuran- 2- ylmethyl)- 6b,7,8,9,9a,10- hexahydro- 6aH- pyrrolo[3',4':3,4]pyrrolo[1,2- a]quinoline- 10- carboxamide
Smiles: O=C(C1C2C(=O)N(C(=O)C2C2N1c1ccccc1C(=C2)C)CC1CCCO1)Nc1ccccc1

STK622209
Synonyms: ethyl4- {(3E)- 2,5- dioxo- 3- [(1,3,5- trimethyl- 1H- pyrazol- 4- yl)methylidene]pyrrolidin- 1- yl}benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)C/C(=C\c2c(C)nn(c2C)C)/C1=O

STK622214
Synonyms: methyl3- [(E)- {[3- (1,3- benzothiazol- 2- yl)- 4- hydroxy- 2- imino- 2,5- dihydro- 1H- pyrrol- 1- yl]imino}methyl]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1/C=N/N1CC(=C(C1=N)c1nc3c(s1)cccc3)O)cccc2

STK622215
Synonyms: 2- [3- (3- bromophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazol- 6- yl]quinoline
Smiles: Brc1cccc(c1)c1nnc2n1nc(s2)c1ccc2c(n1)cccc2

STK622216
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- (7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- methylacetamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)N(C1CCS(=O)(=O)C1)C

STK622217
Synonyms: (2Z)- 8- (3,4- dimethoxybenzyl)- 2- (2,3- dimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(ccc1OC)CN1COc2c(C1)c1O/C(=C\c3cccc(c3OC)OC)/C(=O)c1cc2

STK622219
Synonyms: 1- (furan- 2- ylmethyl)- 5- oxopyrrolidine- 3- carboxamide
Smiles: NC(=O)C1CC(=O)N(C1)Cc1ccco1

STK622220
Synonyms:
Smiles: CCC([C@@H](C(=O)NCc1ccco1)NC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2)C

STK622221
Synonyms: 4- {[3- (4- chlorophenyl)- 4- methylpentyl]amino}tetrahydrothiophene- 3- ol1,1- dioxide
Smiles: CC(C(c1ccc(cc1)Cl)CCNC1CS(=O)(=O)CC1O)C

STK856393
Synonyms: 3- (2- methoxyphenyl)- 4- oxo- 4H- chromen- 7- ylpropanoate
Smiles: CCC(=O)Oc1ccc2c(c1)occ(c2=O)c1ccccc1OC

STK622224
Synonyms: (3E)- 1- (3- chloro- 4- fluorophenyl)- 3- [(5- nitrothiophen- 2- yl)methylidene]pyrrolidine- 2,5- dione
Smiles: O=C1C/C(=C\c2ccc(s2)[N+](=O)[O-])/C(=O)N1c1ccc(c(c1)Cl)F

STK622225
Synonyms: 1- benzyl- 5- (2- chlorophenyl)- 2- hydroxypyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Clc1ccccc1c1ccnc2c1c(=O)nc(n2Cc1ccccc1)O

STK856395
Synonyms: 2- {[6- tert- butyl- 3- cyano- 4- (trifluoromethyl)- 5,6,7,8- tetrahydroquinolin- 2- yl]sulfanyl}- N- methylacetamide
Smiles: CNC(=O)CSc1nc2CCC(Cc2c(c1C#N)C(F)(F)F)C(C)(C)C

STK622229
Synonyms: 6- chloro- 3- {2- [4- (4- chlorophenyl)- 4- hydroxypiperidin- 1- yl]- 2- oxoethyl}- 7- hydroxy- 4- methyl- 2H- chromen- 2- one
Smiles: Clc1ccc(cc1)C1(O)CCN(CC1)C(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl

STK622232
Synonyms: methyl[5- (furan- 2- yl)- 2,2- dimethyl- 8- oxo- 1,8- dihydro- 2H- pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2- d]pyrimidin- 9(4H)- yl]acetate
Smiles: COC(=O)Cn1cnc2c(c1=O)sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1

STK622233
Synonyms: 2- {[(2- hydroxyethyl)sulfanyl]methyl}- 6H- spiro[benzo[h]quinazoline- 5,1'- cyclohexan]- 4- ol
Smiles: OCCSCc1nc(O)c2c(n1)c1ccccc1CC12CCCCC1

STK622234
Synonyms: 2- benzyl- 3- (2- hydroxybenzyl)- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: Oc1ccccc1CC1C(O)c2ccccc2S(=O)(=O)N1Cc1ccccc1

STK622235
Synonyms: [1- (7H- purin- 6- yl)piperidin- 3- yl](pyrrolidin- 1- yl)methanone
Smiles: O=C(N1CCCC1)C1CCCN(C1)c1ncnc2c1[nH]cn2

STK622239
Synonyms: N'- [5,6- dimethyl- 7- (1,3- thiazol- 2- yl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl]- N,N- dimethylpropane- 1,3- diamine
Smiles: CN(CCCNc1ncnc2c1c(C)c(n2c1nccs1)C)C

STK622241
Synonyms: N- (2,3- dihydro- 1H- indol- 1- ylcarbonyl)- L- glutamicacid
Smiles: OC(=O)CC[C@@H](C(=O)O)NC(=O)N1CCc2c1cccc2

STK622243
Synonyms: (5E)- 3- [2- (4- methoxyphenyl)ethyl]- 5- (quinoxalin- 6- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: COc1ccc(cc1)CCN1C(=S)S/C(=C/c2ccc3c(c2)nccn3)/C1=O

STK622245
Synonyms: {(5E)- 5- [(7- hydroxy- 2,3- dihydro[1,4]dioxino[2,3- g]quinolin- 8- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}aceticacid
Smiles: Oc1nc2cc3OCCOc3cc2cc1/C=C\1/SC(=S)N(C1=O)CC(=O)O

STK856398
Synonyms: (2E)- 2- (1- benzofuran- 2- ylmethylidene)- 7- {[bis(2- methoxyethyl)ammonio]methyl}- 4- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: COCC[NH+](Cc1c([O-])cc(c2c1O/C(=C/c1cc3c(o1)cccc3)/C2=O)C)CCOC

STK622248
Synonyms: N- cyclohexyl- 4- hydroxy- 3,6,6- trimethyl- 4,5,6,7- tetrahydro- 1- benzofuran- 2- carboxamide
Smiles: O=C(c1oc2c(c1C)C(O)CC(C2)(C)C)NC1CCCCC1

STK622251
Synonyms: 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- [4- (trifluoromethyl)phenyl]- 4,5,6,7- tetrahydro- 1H- indazole- 3- carboxamide
Smiles: O=C(c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1)Nc1ccc(cc1)C(F)(F)F

STK622252
Synonyms: N- [(1,3- dimethyl- 1H- pyrazol- 4- yl)methyl]- N'- {2- [(3- methoxypropyl)carbamoyl]phenyl}ethanediamide
Smiles: COCCCNC(=O)c1ccccc1NC(=O)C(=O)NCc1cn(nc1C)C

STK622253
Synonyms: N- [2- (3- phenyl- 1,2,4- oxadiazol- 5- yl)ethyl]- 1- (7H- purin- 6- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ncnc2c1[nH]cn2)NCCc1onc(n1)c1ccccc1

STK622254
Synonyms: trans- 4- ({[(4- chlorophenyl)sulfonyl]amino}methyl)- N- [2- (1H- imidazol- 4- yl)ethyl]cyclohexanecarboxamide
Smiles: O=C([C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccc(cc1)Cl)NCCc1nc[nH]c1

STK622255
Synonyms: 1- benzofuran- 2- yl[4- (1,2- benzothiazol- 3- yl)piperazin- 1- yl]methanone
Smiles: O=C(c1cc2c(o1)cccc2)N1CCN(CC1)c1nsc2c1cccc2

STK622257
Synonyms: N~6~- (1,3- benzodioxol- 5- yl)- 7H- purine- 2,6- diamine
Smiles: Nc1nc(Nc2ccc3c(c2)OCO3)c2c(n1)nc[nH]2

STK856401
Synonyms: methyl2- {[(2Z)- 2- (2- ethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl]oxy}propanoate
Smiles: CCOc1ccccc1/C=C/1\Oc2c(C1=O)ccc(c2)OC(C(=O)OC)C

STK856402
Synonyms: (2Z)- 2- (2- chlorobenzylidene)- 8- (pyridin- 4- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2ccccc2Cl)/Oc2c1ccc1c2CN(CO1)Cc1ccncc1

STK622260
Synonyms: N- (2- hydroxyethyl)- N'- {2- [(pyridin- 3- ylmethyl)carbamoyl]phenyl}ethanediamide
Smiles: OCCNC(=O)C(=O)Nc1ccccc1C(=O)NCc1cccnc1

STK622264
Synonyms: 3- (4- chlorophenyl)- 1- [(2- oxo- 1,2- dihydroquinolin- 4- yl)methyl]- 1- propan- 2- ylurea
Smiles: Clc1ccc(cc1)NC(=O)N(C(C)C)Cc1cc(=O)[nH]c2c1cccc2

STK622265
Synonyms: N- [2- (2,4- dichlorophenyl)ethyl]- 3- [(4S)- 1- (furan- 2- ylmethyl)- 2,5- dioxoimidazolidin- 4- yl]propanamide
Smiles: O=C(CC[C@@H]1NC(=O)N(C1=O)Cc1ccco1)NCCc1ccc(cc1Cl)Cl

STK622267
Synonyms: (2Z)- 2- (3- methylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yldiphenylcarbamate
Smiles: Cc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)N(c1ccccc1)c1ccccc1

STK622268
Synonyms: 5- (4- chlorobenzyl)- 4- (pyridin- 3- yl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Clc1ccc(cc1)Cc1n[nH]c(=S)n1c1cccnc1

STK856403
Synonyms: ethyl3- (2- methoxyphenyl)- 7- {[(4- methoxyphenyl)carbonyl]oxy}- 4- oxo- 4H- chromene- 2- carboxylate
Smiles: CCOC(=O)c1oc2cc(ccc2c(=O)c1c1ccccc1OC)OC(=O)c1ccc(cc1)OC

STK622269
Synonyms: 2- (2- chlorophenyl)- 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- N- [3- (morpholin- 4- yl)propyl]- 1,3- oxazol- 5- amine
Smiles: Clc1ccccc1c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NCCCN1CCOCC1

STK622271
Synonyms: N- [(4- hydroxyphthalazin- 1- yl)acetyl]isoleucine
Smiles: CCC(C(C(=O)O)NC(=O)Cc1nnc(c2c1cccc2)O)C

STK622275
Synonyms: N- [2- (1- benzylpiperidin- 4- yl)ethyl]- 2- (7- methoxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)acetamide
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)NCCC1CCN(CC1)Cc1ccccc1

STK622276
Synonyms: 4- {[2- (morpholin- 4- ylsulfonyl)ethyl](pyridin- 2- ylmethyl)amino}- 4- oxobutanoicacid
Smiles: OC(=O)CCC(=O)N(Cc1ccccn1)CCS(=O)(=O)N1CCOCC1

STK622278
Synonyms: 5- (4,4- dimethyl- 1,1- dioxido- 3- oxo- 1,2- thiazolidin- 2- yl)- 2- methoxy- N- [2- (propan- 2- yloxy)phenyl]benzenesulfonamide
Smiles: COc1ccc(cc1S(=O)(=O)Nc1ccccc1OC(C)C)N1C(=O)C(CS1(=O)=O)(C)C

STK622282
Synonyms: 2- (2- methylphenyl)- 1,2,4,5,6,7- hexahydro- 3H- indazol- 3- one
Smiles: Cc1ccccc1n1[nH]c2c(c1=O)CCCC2

STK622284
Synonyms: [4- (2- chloro- 7H- purin- 6- yl)piperazin- 1- yl](2,3- dihydro- 1,4- benzodioxin- 2- yl)methanone
Smiles: O=C(C1COc2c(O1)cccc2)N1CCN(CC1)c1nc(Cl)nc2c1[nH]cn2

STK622286
Synonyms: (5S)- 5- [3- (azepan- 1- yl)- 3- oxopropyl]- 3- [2- (5- chloro- 1H- indol- 3- yl)ethyl]imidazolidine- 2,4- dione
Smiles: Clc1ccc2c(c1)c(CCN1C(=O)N[C@H](C1=O)CCC(=O)N1CCCCCC1)c[nH]2

STK622289
Synonyms: N- (2- {[(4,6- dimethylpyrimidin- 2- yl)sulfanyl]methyl}- 1- methyl- 1H- benzimidazol- 5- yl)propanamide
Smiles: CCC(=O)Nc1ccc2c(c1)nc(n2C)CSc1nc(C)cc(n1)C

STK622292
Synonyms: 2- tert- butyl- 7- (4- fluorophenyl)- 8,9- dimethyl- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Fc1ccc(cc1)n1c(C)c(c2c1ncn1c2nc(n1)C(C)(C)C)C

STK622293
Synonyms: 1- cyclopropyl- 6,7- difluoro- N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- 8- methoxy- 4- oxo- 1,4- dihydroquinoline- 3- carboxamide
Smiles: COc1c(F)c(F)cc2c1n(cc(c2=O)C(=O)NCCc1c[nH]c2c1cc(F)cc2)C1CC1

STK622294
Synonyms: (3aS,6R)- N- [2- (4- methoxyphenyl)ethyl]- 2- (5- methyl- 1,2- oxazol- 3- yl)- 1- oxo- 1,2,3,6,7,7a- hexahydro- 3a,6- epoxyisoindole- 7- carboxamide
Smiles: COc1ccc(cc1)CCNC(=O)C1[C@@H]2C=C[C@@]3(C1C(=O)N(C3)c1noc(c1)C)O2

STK622295
Synonyms: (5E)- 5- [(6- hydroxy[1,3]dioxolo[4,5- g]quinolin- 7- yl)methylidene]- 3- (2- phenylethyl)- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C/c2cc3cc4OCOc4cc3nc2O)/C(=O)N1CCc1ccccc1

STK622296
Synonyms: 7- hydroxy- 4- methyl- 3- {2- [4- (4- methylquinolin- 2- yl)piperazin- 1- yl]- 2- oxoethyl}- 2H- chromen- 2- one
Smiles: Oc1ccc2c(c1)oc(=O)c(c2C)CC(=O)N1CCN(CC1)c1cc(C)c2c(n1)cccc2

STK622297
Synonyms: 1- {[4- (acetylamino)phenyl]sulfonyl}- N- (1,2,3,4- tetrahydronaphthalen- 1- yl)piperidine- 4- carboxamide
Smiles: CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CCCc2c1cccc2

STK622299
Synonyms: N- phenyl- 2- [2- (pyrrolidin- 1- yl)ethyl]piperidine- 1- carboxamide
Smiles: O=C(N1CCCCC1CCN1CCCC1)Nc1ccccc1

STK622300
Synonyms: 4- (1H- indol- 3- ylcarbonyl)- N- [3- oxo- 3- (phenylamino)propyl]piperazine- 1- carboxamide
Smiles: O=C(Nc1ccccc1)CCNC(=O)N1CCN(CC1)C(=O)c1c[nH]c2c1cccc2

STK856406
Synonyms: (2Z)- 2- (3- fluorobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylbenzenesulfonate
Smiles: Fc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccccc1

STK622303
Synonyms: N- [(2Z)- 4- phenyl- 5- [(phenylacetyl)amino]- 1,3- thiazol- 2(3H)- ylidene]cyclopropanecarboxamide
Smiles: O=C(Nc1s/c(=N\C(=O)C2CC2)/[nH]c1c1ccccc1)Cc1ccccc1

STK622304
Synonyms: 3- [(4S)- 1- benzyl- 2,5- dioxoimidazolidin- 4- yl]- N- (4- phenoxyphenyl)propanamide
Smiles: O=C(Nc1ccc(cc1)Oc1ccccc1)CC[C@@H]1NC(=O)N(C1=O)Cc1ccccc1

STK622307
Synonyms: propyl4- {[9- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4- oxo- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 3- yl]oxy}benzoate
Smiles: CCCOC(=O)c1ccc(cc1)Oc1coc2c(c1=O)ccc1c2CN(CO1)C1CCS(=O)(=O)C1

STK856407
Synonyms: (2Z)- 2- [(5- methylfuran- 2- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzenesulfonate
Smiles: Fc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(o1)C)/C2=O

STK622310
Synonyms: N- {3- [4- (4- chlorophenyl)- 4- hydroxypiperidin- 1- yl]- 3- oxopropyl}- 2,2- diphenylacetamide
Smiles: O=C(C(c1ccccc1)c1ccccc1)NCCC(=O)N1CCC(CC1)(O)c1ccc(cc1)Cl

STK622312
Synonyms: 2- (1,3- benzodioxol- 5- yloxy)- N- [3- cyano- 4,5- dimethyl- 1- (pyridin- 3- yl)- 1H- pyrrol- 2- yl]acetamide
Smiles: N#Cc1c(C)c(n(c1NC(=O)COc1ccc2c(c1)OCO2)c1cccnc1)C

STK622313
Synonyms: N~2~- (2- chloro- 7H- purin- 6- yl)- N- [3- (diethylamino)propyl]glycinamide
Smiles: CCN(CCCNC(=O)CNc1nc(Cl)nc2c1[nH]cn2)CC

STK856408
Synonyms: ethyl({(2Z)- 2- [(6- bromo- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl}oxy)acetate
Smiles: CCOC(=O)COc1ccc2c(c1)O/C(=C\c1cc(Br)cc3c1OCOC3)/C2=O

STK622316
Synonyms: N- [4- (acetylamino)phenyl]- 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)NC(=O)C)CSc1nc(Cl)nc2c1[nH]cn2

STK622317
Synonyms: N- (2- chlorophenyl)- 1- (pyrimidin- 2- yl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)c1ncccn1)Nc1ccccc1Cl

STK622318
Synonyms: (2E)- 6- [(4- chlorobenzyl)oxy]- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 1- benzofuran- 3(2H)- one
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2C)OCc1ccc(cc1)Cl

STK622319
Synonyms: N- cyclopentyl- 4- [4- (1H- indol- 2- ylcarbonyl)piperazin- 1- yl]- 4- oxobutanamide
Smiles: O=C(NC1CCCC1)CCC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2

STK622321
Synonyms: 1- (3,5- dimethoxyphenyl)- 3- (4- hydroxy- 6- propylpyrimidin- 2- yl)guanidine
Smiles: CCCc1nc(NC(=N)Nc2cc(OC)cc(c2)OC)nc(c1)O

STK622322
Synonyms: N- (1- benzyl- 3,5- dimethyl- 1H- pyrazol- 4- yl)- N'- [(2R)- 2- hydroxypropyl]ethanediamide
Smiles: C[C@H](CNC(=O)C(=O)Nc1c(C)nn(c1C)Cc1ccccc1)O

STK622323
Synonyms: 4- (2- chlorobenzyl)- 2- (2- methoxyphenyl)- 5- methyl- 1,2- dihydro- 3H- pyrazol- 3- one
Smiles: COc1ccccc1n1[nH]c(c(c1=O)Cc1ccccc1Cl)C

STK622326
Synonyms: N- {2- oxo- 2- [(pyridin- 2- ylmethyl)amino]ethyl}- 3- phenyl- 2,1- benzoxazole- 5- carboxamide
Smiles: O=C(CNC(=O)c1ccc2c(c1)c(on2)c1ccccc1)NCc1ccccn1

STK856409
Synonyms: 1- (2,1,3- benzoxadiazol- 4- ylsulfonyl)- N- benzylpiperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)S(=O)(=O)c1cccc2c1non2)NCc1ccccc1

STK622328
Synonyms: ethyl5- (2- ethoxy- 2- oxo- 1- phenylethoxy)- 2- phenyl- 1- benzofuran- 3- carboxylate
Smiles: CCOC(=O)C(c1ccccc1)Oc1ccc2c(c1)c(C(=O)OCC)c(o2)c1ccccc1

STK622332
Synonyms: N- [(6- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methyl]- N- propylpyridine- 4- carboxamide
Smiles: CCCN(C(=O)c1ccncc1)Cc1cc2cc(OC)ccc2[nH]c1=O

STK622333
Synonyms: N- [2- (1H- indol- 3- yl)ethyl]- 1- (5- nitropyridin- 2- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ccc(cn1)[N+](=O)[O-])NCCc1c[nH]c2c1cccc2

STK622337
Synonyms: 3- (3- chloro- 1,2- oxazol- 5- yl)- N- (pyridin- 3- ylmethyl)- N- [2- (pyrrolidin- 1- ylsulfonyl)ethyl]propanamide
Smiles: O=C(N(Cc1cccnc1)CCS(=O)(=O)N1CCCC1)CCc1onc(c1)Cl

STK622338
Synonyms: (2Z)- N- [3- (acetylamino)phenyl]- 2- {[(4- methoxyphenyl)sulfonyl]imino}- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)/N=c/1\sc2c([nH]1)ccc(c2)C(=O)Nc1cccc(c1)NC(=O)C

STK622346
Synonyms: (2Z)- 2- (4- methylbenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzenesulfonate
Smiles: Cc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OS(=O)(=O)c1ccc(cc1)F

STK622347
Synonyms: 9- (3,4- dimethoxybenzyl)- 3- (2- methoxyphenyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1cc(ccc1OC)CN1COc2c(C1)c1occ(c(=O)c1cc2)c1ccccc1OC

STK622348
Synonyms: N- [(5E)- 5- (2H- chromen- 3- ylmethylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]pyridine- 3- carboxamide
Smiles: O=C(c1cccnc1)NN1C(=S)S/C(=C/C2=Cc3c(OC2)cccc3)/C1=O

STK622350
Synonyms: 5- tert- butyl- N- [2- (1H- indol- 3- yl)ethyl]- 1H- pyrazole- 3- carboxamide
Smiles: O=C(c1n[nH]c(c1)C(C)(C)C)NCCc1c[nH]c2c1cccc2

STK622351
Synonyms: 5- amino- 1- (4- fluorophenyl)- N- [3- (methylsulfanyl)phenyl]- 1H- 1,2,3- triazole- 4- carboxamide
Smiles: CSc1cccc(c1)NC(=O)c1nnn(c1N)c1ccc(cc1)F

STK622353
Synonyms: azepan- 1- yl[1- (2,1,3- benzothiadiazol- 4- ylsulfonyl)piperidin- 3- yl]methanone
Smiles: O=C(N1CCCCCC1)C1CCCN(C1)S(=O)(=O)c1cccc2c1nsn2

STK622356
Synonyms: trans- N- (2- {[2- (morpholin- 4- yl)ethyl]amino}- 2- oxoethyl)- 4- {[(phenylsulfonyl)amino]methyl}cyclohexanecarboxamide
Smiles: O=C([C@@H]1CC[C@H](CC1)CNS(=O)(=O)c1ccccc1)NCC(=O)NCCN1CCOCC1

STK622357
Synonyms: N- [3- cyano- 4,5- dimethyl- 1- (pyridin- 2- yl)- 1H- pyrrol- 2- yl]- 2- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)CC(=O)Nc1n(c2ccccn2)c(c(c1C#N)C)C

STK622362
Synonyms: 4- (2- chlorophenyl)- 2- (2,3- dihydro- 1H- indol- 1- yl)- 8- methyl- 4,9- dihydro- 6H- pyrimido[1,2- a][1,3,5]triazin- 6- one
Smiles: Cc1cc(=O)n2c(=NC(=NC2c2ccccc2Cl)N2CCc3c2cccc3)[nH]1

STK622364
Synonyms: methyl3- [(E)- {3- [3- (morpholin- 4- yl)propyl]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 5- ylidene}methyl]- 1H- indole- 2- carboxylate
Smiles: COC(=O)c1[nH]c2c(c1/C=C\1/SC(=S)N(C1=O)CCCN1CCOCC1)cccc2

STK622369
Synonyms: 5- butyl- 2- [4- (4- methoxyphenyl)piperazin- 1- yl]- 6- methylpyrimidin- 4- ol
Smiles: CCCCc1c(C)nc(nc1O)N1CCN(CC1)c1ccc(cc1)OC

STK622371
Synonyms: N- [2- (5- fluoro- 1H- indol- 3- yl)ethyl]- 2- (morpholin- 4- yl)pyridine- 4- carboxamide
Smiles: Fc1ccc2c(c1)c(CCNC(=O)c1ccnc(c1)N1CCOCC1)c[nH]2

STK856411
Synonyms: (2Z)- 3- oxo- 2- (thiophen- 2- ylmethylidene)- 2,3- dihydro- 1- benzofuran- 6- yl2,2- dimethylpropanoate
Smiles: O=C(C(C)(C)C)Oc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O

STK622374
Synonyms: 3- {[5- (4- fluorophenyl)furan- 2- yl]methyl}- 2- methyl- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: Fc1ccc(cc1)c1ccc(o1)CC1C(O)c2ccccc2S(=O)(=O)N1C

STK622376
Synonyms: 2- [5- (2,3- dimethoxyphenyl)- 3- methyl- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- (4- methoxyphenyl)- 1,3- thiazole
Smiles: COc1ccc(cc1)c1csc(n1)N1N=C(CC1c1cccc(c1OC)OC)C

STK622379
Synonyms: 2- (4- ethylphenyl)- 2- (1H- indol- 3- yl)ethanamine
Smiles: NCC(c1c[nH]c2c1cccc2)c1ccc(cc1)CC

STK622380
Synonyms: N- [3- (1H- imidazol- 1- yl)propyl]- N~3~- (5- nitropyridin- 2- yl)- beta- alaninamide
Smiles: O=C(NCCCn1cncc1)CCNc1ccc(cn1)[N+](=O)[O-]

STK622381
Synonyms: 6- amino- 2- hydroxy- 3- methyl- 5- (3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)pyrimidin- 4(3H)- one
Smiles: Nc1nc(O)n(c(=O)c1C1OC(=O)c2c1cccc2)C

STK622383
Synonyms: 4- (2,4- dichlorophenyl)- 8- methyl- 2- (morpholin- 4- yl)- 4,9- dihydro- 6H- pyrimido[1,2- a][1,3,5]triazin- 6- one
Smiles: Clc1ccc(c(c1)Cl)C1N=C(N=c2n1c(=O)cc([nH]2)C)N1CCOCC1

STK622386
Synonyms: N'- [2- (3,5- dimethyl- 1H- pyrazol- 1- yl)- 6,6- dimethyl- 5,8- dihydro- 6H- pyrano[4',3':4,5]thieno[2,3- d]pyrimidin- 4- yl]- N,N- dimethylethane- 1,2- diamine
Smiles: CN(CCNc1nc(nc2c1c1CC(C)(C)OCc1s2)n1nc(cc1C)C)C

STK622387
Synonyms: (2Z)- 8- [2- (4- methoxyphenyl)ethyl]- 2- (pyridin- 4- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1)CCN1COc2c(C1)c1O/C(=C\c3ccncc3)/C(=O)c1cc2

STK622393
Synonyms: 2- [2- (3,4- dimethoxyphenyl)- 1,3- thiazol- 4- yl]- N- (1,1- dioxido- 2,3- dihydrothiophen- 3- yl)acetamide
Smiles: COc1cc(ccc1OC)c1scc(n1)CC(=O)NC1C=CS(=O)(=O)C1

STK622395
Synonyms: 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (3- methoxyphenyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nc(Cl)nc2c1[nH]cn2

STK622396
Synonyms: (2Z)- 8- (pyridin- 2- ylmethyl)- 2- (pyridin- 3- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2cccnc2)/Oc2c1ccc1c2CN(CO1)Cc1ccccn1

STK622397
Synonyms: 5- (4- fluorophenyl)- 2- hydroxypyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Fc1ccc(cc1)c1ccnc2c1c(=O)nc([nH]2)O

STK622398
Synonyms: 2- [3- (3,4- dihydroquinolin- 1(2H)- ylsulfonyl)- 4- methoxyphenyl]- 4,4- dimethyl- 1,2- thiazolidin- 3- one1,1- dioxide
Smiles: COc1ccc(cc1S(=O)(=O)N1CCCc2c1cccc2)N1C(=O)C(CS1(=O)=O)(C)C

STK622399
Synonyms: N- (4- acetylphenyl)- 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- 4,5,6,7- tetrahydro- 1H- indazole- 3- carboxamide
Smiles: O=C(c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1)Nc1ccc(cc1)C(=O)C

STK622401
Synonyms: 3- [3- (1,3- benzodioxol- 5- yl)- 1,2,4- oxadiazol- 5- yl]- 5- methyl- 4,5,6,7- tetrahydro- 2H- indazole
Smiles: CC1CCc2c(C1)c([nH]n2)c1onc(n1)c1ccc2c(c1)OCO2

STK622404
Synonyms: N- [4- (3- ethyl- 2- hydroxy- 6- oxo- 3,4,5,6- tetrahydropyridin- 3- yl)phenyl]- 2,6- dimethoxybenzamide
Smiles: CCC1(CCC(=O)N=C1O)c1ccc(cc1)NC(=O)c1c(OC)cccc1OC

STK622405
Synonyms: 2- hydroxy- 5- (3- methoxyphenyl)- 1- (tetrahydrofuran- 2- ylmethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: COc1cccc(c1)c1ccnc2c1c(=O)nc(n2CC1CCCO1)O

STK622409
Synonyms: (10aS)- 7,8- dimethoxy- 2- [3- oxo- 3- (pyrrolidin- 1- yl)propyl]- 10,10a- dihydroimidazo[1,5- b]isoquinoline- 1,3(2H,5H)- dione
Smiles: COc1cc2CN3C(=O)N(C(=O)[C@@H]3Cc2cc1OC)CCC(=O)N1CCCC1

STK622410
Synonyms: 6- chloro- 4- ethyl- 8- {[(1- hydroxy- 2- methylpropan- 2- yl)ammonio]methyl}- 2- oxo- 2H- chromen- 7- olate
Smiles: OCC([NH2+]Cc1c([O-])c(Cl)cc2c1oc(=O)cc2CC)(C)C

STK622411
Synonyms: N- (6- methylheptan- 2- yl)- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: CC(CCCC(NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)C)C

STK856413
Synonyms: 3- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 2- methyl- 4- oxo- 4H- chromen- 7- ylacetate
Smiles: CC(=O)Oc1ccc2c(c1)oc(c(c2=O)c1ccc2c(c1)OCCO2)C

STK622412
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- (2- hydroxy- 4- oxoquinazolin- 3(4H)- yl)- N- methylacetamide
Smiles: O=C(N(C1CCS(=O)(=O)C1)C)Cn1c(O)nc2c(c1=O)cccc2

STK622416
Synonyms: 3- {(Z)- [2- (2- methoxyphenyl)- 5- oxo- 1,3- oxazol- 4(5H)- ylidene]methyl}- N,N- dimethyl- 1H- indole- 1- sulfonamide
Smiles: COc1ccccc1C1=N/C(=C\c2cn(c3c2cccc3)S(=O)(=O)N(C)C)/C(=O)O1

STK622417
Synonyms: 3- (4- methoxyphenyl)- 2,5- dimethyl- 6- (3- methylbutyl)pyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: COc1ccc(cc1)c1c(C)nn2c1nc(C)c(c2O)CCC(C)C

STK622418
Synonyms: 1- (3,4- dihydroisoquinolin- 2(1H)- yl)- 2- [2- (3,4,5- trimethoxyphenyl)- 1,3- thiazol- 4- yl]ethanone
Smiles: COc1cc(cc(c1OC)OC)c1scc(n1)CC(=O)N1CCc2c(C1)cccc2

STK622419
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- 2- [(5Z)- 5- (3- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- methylacetamide
Smiles: Fc1cccc(c1)/C=C/1\SC(=S)N(C1=O)CC(=O)N(C1CCS(=O)(=O)C1)C

STK622433
Synonyms: 3- (4- chlorophenyl)- 2,6- diethyl- 5- methylpyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: CCc1nn2c(c1c1ccc(cc1)Cl)nc(c(c2O)CC)C

STK622434
Synonyms: 2- (7- hydroxy- 4- methyl- 2- oxo- 2H- chromen- 3- yl)- N- [(2Z)- 4- methyl- 1,3- thiazol- 2(3H)- ylidene]acetamide
Smiles: Oc1ccc2c(c1)oc(=O)c(c2C)CC(=O)/N=c/1\scc([nH]1)C

STK622436
Synonyms: (2Z)- 2- [(5- bromo- 1- benzofuran- 2- yl)methylidene]- 7- (morpholin- 4- ium- 4- ylmethyl)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- olate
Smiles: Brc1ccc2c(c1)cc(o2)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCOCC1)[O-]

STK856415
Synonyms: 3- (2- methoxyphenyl)- 4- oxo- 4H- chromen- 7- yl2- methoxybenzoate
Smiles: COc1ccccc1C(=O)Oc1ccc2c(c1)occ(c2=O)c1ccccc1OC

STK622441
Synonyms:
Smiles: CCC([C@@H](C(=O)O)NC(=O)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)OC)C

STK622444
Synonyms: 5- methyl- 3- [3- (pyridin- 3- yl)- 1,2,4- oxadiazol- 5- yl]- 4,5,6,7- tetrahydro- 2H- indazole
Smiles: CC1CCc2c(C1)c([nH]n2)c1onc(n1)c1cccnc1

STK622445
Synonyms: N- (furan- 2- ylmethyl)- 2- (7H- purin- 6- ylsulfanyl)propanamide
Smiles: O=C(C(Sc1ncnc2c1[nH]cn2)C)NCc1ccco1

STK622446
Synonyms: trans- 4- ({[(4- methoxyphenyl)sulfonyl]amino}methyl)- N- {(2S)- 1- oxo- 1- [(pyridin- 3- ylmethyl)amino]propan- 2- yl}cyclohexanecarboxamide
Smiles: COc1ccc(cc1)S(=O)(=O)NC[C@@H]1CC[C@H](CC1)C(=O)N[C@H](C(=O)NCc1cccnc1)C

STK622449
Synonyms: 2- methyl- N- [4- (1H- 1,2,4- triazol- 1- ylmethyl)phenyl]quinoline- 4- carboxamide
Smiles: Cc1nc2ccccc2c(c1)C(=O)Nc1ccc(cc1)Cn1cncn1

STK622452
Synonyms: methyl(2- ethyl- 7- hydroxy- 5- methyl- 3- phenylpyrazolo[1,5- a]pyrimidin- 6- yl)acetate
Smiles: COC(=O)Cc1c(C)nc2n(c1O)nc(c2c1ccccc1)CC

STK622453
Synonyms: 4,6- dimethyl- 3- [7- (trifluoromethyl)- 2,3- dihydro- 1H- 1,4- diazepin- 5- yl]pyridin- 2- ol
Smiles: Cc1cc(C)c(c(n1)O)C1=NCCNC(=C1)C(F)(F)F

STK622457
Synonyms: N- {4- [4- (propan- 2- yl)phenyl]- 1,2,5- oxadiazol- 3- yl}pentanamide
Smiles: CCCCC(=O)Nc1nonc1c1ccc(cc1)C(C)C

STK622458
Synonyms: [2,5- dimethyl- 7- (pyridin- 4- yl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl](morpholin- 4- yl)methanone
Smiles: O=C(C1=C(C)N=c2n(C1c1ccncc1)nc([nH]2)C)N1CCOCC1

STK622460
Synonyms: (2Z)- 2- (3- bromobenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzenesulfonate
Smiles: Fc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1cccc(c1)Br)/C2=O

STK622461
Synonyms: (5E)- 2- (pyridin- 2- ylamino)- 5- (quinoxalin- 2- ylmethylidene)- 1,3- thiazol- 4(5H)- one
Smiles: O=C1N=C(S/C/1=C/c1cnc2c(n1)cccc2)Nc1ccccn1

STK622462
Synonyms: methyl{2- [4- (2- fluorophenyl)piperazin- 1- yl]- 6- hydroxypyrimidin- 4- yl}acetate
Smiles: COC(=O)Cc1cc(O)nc(n1)N1CCN(CC1)c1ccccc1F

STK622463
Synonyms: 6- [2- (3,4- dimethoxyphenyl)ethyl]- 3- (4- fluorophenyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: COc1cc(CCc2nn3c(s2)nnc3c2ccc(cc2)F)ccc1OC

STK622470
Synonyms: 4- {(5E)- 5- [(7- methoxy- 2- oxo- 1,2- dihydroquinolin- 3- yl)methylidene]- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl}benzoicacid
Smiles: COc1ccc2c(c1)[nH]c(=O)c(c2)/C=C\1/SC(=S)N(C1=O)c1ccc(cc1)C(=O)O

STK622471
Synonyms: 1- {[(5- hydroxy- 4,7- dimethyl- 2- oxo- 2H- chromen- 3- yl)acetyl]oxy}pyrrolidine- 2,5- dione
Smiles: O=C(Cc1c(=O)oc2c(c1C)c(O)cc(c2)C)ON1C(=O)CCC1=O

STK622474
Synonyms: N- benzyl- 1- (9H- purin- 6- yl)piperidine- 4- carboxamide
Smiles: O=C(C1CCN(CC1)c1ncnc2c1nc[nH]2)NCc1ccccc1

STK622475
Synonyms: [7- (4- chlorophenyl)- 5- methyl- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl](phenyl)methanone
Smiles: Clc1ccc(cc1)C1C(=C(C)N=c2n1nc[nH]2)C(=O)c1ccccc1

STK622477
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzoate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OC(=O)c1ccc(cc1)Cl)cn2C

STK622478
Synonyms: (1Z)- N- ({8,9- dimethyl- 7- [3- (morpholin- 4- yl)propyl]- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 2- yl}methoxy)- 1- (4- methoxyphenyl)ethanimine
Smiles: COc1ccc(cc1)/C(=N\OCc1nc2n(n1)cnc1c2c(C)c(n1CCCN1CCOCC1)C)/C

STK622481
Synonyms: (2Z)- 8- [2- (4- methoxyphenyl)ethyl]- 2- (pyridin- 3- ylmethylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1)CCN1COc2c(C1)c1O/C(=C\c3cccnc3)/C(=O)c1cc2

STK622484
Synonyms: 2- (4- hydroxyphthalazin- 1- yl)- 1- {4- [2- (pyridin- 2- yl)ethyl]piperazin- 1- yl}ethanone
Smiles: O=C(N1CCN(CC1)CCc1ccccn1)Cc1nnc(c2c1cccc2)O

STK622485
Synonyms: 2- [(4- oxo- 3- phenyl- 4H- chromen- 7- yl)oxy]- N- (1,3- thiazol- 2- yl)acetamide
Smiles: O=C(Nc1nccs1)COc1ccc2c(c1)occ(c2=O)c1ccccc1

STK622487
Synonyms: (5Z)- 3- {3- [2- (2- hydroxyethyl)piperidin- 1- yl]- 3- oxopropyl}- 5- [(2E)- 3- phenylprop- 2- en- 1- ylidene]- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: OCCC1CCCCN1C(=O)CCN1C(=S)S/C(=C\C=C\c2ccccc2)/C1=O

STK622488
Synonyms: 3,3,8- trimethyl- 6- [4- (prop- 2- en- 1- yl)piperazin- 1- yl]- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: C=CCN1CCN(CC1)c1nc(C)c2c(c1C#N)CC(OC2)(C)C

STK622489
Synonyms: 7- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl]- 3- phenyl- 4H- [1,3,4]thiadiazolo[2,3- c][1,2,4]triazin- 4- one
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc(c2=O)c1ccccc1)C

STK622490
Synonyms: 3- benzyl- 2- methylpyrimido[1,2- a]benzimidazol- 4- ol
Smiles: Cc1nc2nc3c(n2c(c1Cc1ccccc1)O)cccc3

STK622491
Synonyms: 7,8- dihydro- 1H,6H- [1,4]dioxepino[2,3- f]benzimidazole- 2- thiol
Smiles: Sc1nc2c([nH]1)cc1c(c2)OCCCO1

STK622499
Synonyms: N- [(2Z)- 5- (benzylsulfonyl)- 1,3,4- thiadiazol- 2(3H)- ylidene]- 2- (2- fluorophenoxy)butanamide
Smiles: CCC(C(=O)/N=c\1/[nH]nc(s1)S(=O)(=O)Cc1ccccc1)Oc1ccccc1F

STK622500
Synonyms: (2E)- 2- [(methylsulfonyl)imino]- N- (2- phenylethyl)- 2,3- dihydro- 1,3- benzothiazole- 6- carboxamide
Smiles: O=C(c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[nH]2)NCCc1ccccc1

STK622501
Synonyms: 2- methyl- 3- phenyl- 9- [2- (thiophen- 2- yl)ethyl]- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: Cc1oc2c3CN(COc3ccc2c(=O)c1c1ccccc1)CCc1cccs1

STK622503
Synonyms: 4- [(5E)- 4- oxo- 5- (quinoxalin- 6- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1C(=S)S/C(=C/c2ccc3c(c2)nccn3)/C1=O

STK622505
Synonyms: N- [(4E)- 2- (2,3- dihydro- 1,4- benzodioxin- 6- yl)- 4H- chromen- 4- ylidene]- 4- (2,4- dimethoxyphenyl)- 5- methyl- 1,3- thiazol- 2- amine
Smiles: COc1ccc(c(c1)OC)c1nc(sc1C)/N=c/1\cc(oc2c1cccc2)c1ccc2c(c1)OCCO2

STK622508
Synonyms: ethyl4- (3,4- dimethoxyphenyl)- 2- [4- (ethoxycarbonyl)piperazin- 1- yl]- 6- oxo- 1,4,5,6- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=NC1c1ccc(c(c1)OC)OC)N1CCN(CC1)C(=O)OCC

STK856420
Synonyms: [5- methyl- 7- (pyridin- 3- yl)- 3,7- dihydro[1,2,4]triazolo[1,5- a]pyrimidin- 6- yl](piperidin- 1- yl)methanone
Smiles: CC1=C(C(=O)N2CCCCC2)C(n2c(=N1)[nH]cn2)c1cccnc1

STK622513
Synonyms: 3- [(5E)- 5- (furan- 2- ylmethylidene)- 2,4- dioxo- 1,3- thiazolidin- 3- yl]- N- [2- hydroxy- 2- (4- hydroxyphenyl)ethyl]- N- methylpropanamide
Smiles: Oc1ccc(cc1)C(CN(C(=O)CCN1C(=O)S/C(=C/c2ccco2)/C1=O)C)O

STK622515
Synonyms: (5E)- 5- [(7- hydroxy- 2,3- dihydro[1,4]dioxino[2,3- g]quinolin- 8- yl)methylidene]- 3- phenyl- 2- thioxo- 1,3- thiazolidin- 4- one
Smiles: S=C1S/C(=C/c2cc3cc4OCCOc4cc3nc2O)/C(=O)N1c1ccccc1

STK622518
Synonyms: 3- phenyl- 9- (pyridin- 2- ylmethyl)- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: O=c1c(coc2c1ccc1c2CN(CO1)Cc1ccccn1)c1ccccc1

STK622519
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 6- [(4- methoxybenzyl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: COc1ccc(cc1)COc1ccc2c(c1)O/C(=C\c1cc(Cl)cc3c1OCOC3)/C2=O

STK622521
Synonyms: 2- {[3- (4- methoxyphenyl)- 2- methyl- 4- oxo- 4H- chromen- 7- yl]oxy}- N- (1,3- thiazol- 2- yl)acetamide
Smiles: COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCC(=O)Nc1nccs1

STK622522
Synonyms: 4- (1,3- benzodioxol- 5- yl)- 5- (4- bromophenyl)- 2,4- dihydro- 3H- 1,2,4- triazole- 3- thione
Smiles: Brc1ccc(cc1)c1n[nH]c(=S)n1c1ccc2c(c1)OCO2

STK622523
Synonyms: N- (5- methylpyridin- 2- yl)- 2- (4- oxoquinazolin- 3(4H)- yl)acetamide
Smiles: O=C(Cn1cnc2c(c1=O)cccc2)Nc1ccc(cn1)C

STK856421
Synonyms: (2Z)- 6- [(3- methylbut- 2- en- 1- yl)oxy]- 2- (thiophen- 2- ylmethylidene)- 1- benzofuran- 3(2H)- one
Smiles: CC(=CCOc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O)C

STK622526
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- tert- butylbenzoate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OC(=O)c1ccc(cc1)C(C)(C)C)cn2C

STK622531
Synonyms: (4Z)- 2- ethoxy- 4- {4- ethoxy- 1,3- dimethyl- 8- [(4- methylphenyl)amino]- 6H- cyclohepta[c]furan- 6- ylidene}cyclohexa- 2,5- dien- 1- one
Smiles: CCOC1=C/C(=C/2\C=C(OCC)c3c(C(=C2)Nc2ccc(cc2)C)c(oc3C)C)/C=CC1=O

STK622534
Synonyms: 3- (4,5- dimethoxy- 3- oxo- 1,3- dihydro- 2- benzofuran- 1- yl)- 1- ethyl- 4- hydroxy- 6- methylpyridin- 2(1H)- one
Smiles: COc1c(OC)ccc2c1C(=O)OC2c1c(O)cc(n(c1=O)CC)C

STK622537
Synonyms: 3- (3- fluorophenyl)- 6- [5- (2- methylpropyl)- 1H- pyrazol- 3- yl][1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: CC(Cc1[nH]nc(c1)c1nn2c(s1)nnc2c1cccc(c1)F)C

STK622538
Synonyms: (2Z)- 2- (4- methoxybenzylidene)- 8- (pyridin- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccccn1

STK622539
Synonyms: N- {2- oxo- 2- [(pyridin- 3- ylmethyl)amino]ethyl}- 3- phenyl- 2,1- benzoxazole- 5- carboxamide
Smiles: O=C(CNC(=O)c1ccc2c(c1)c(on2)c1ccccc1)NCc1cccnc1

STK622542
Synonyms: 3- (4- bromophenyl)- 6- (5- bromopyridin- 3- yl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Brc1ccc(cc1)c1nnc2n1nc(s2)c1cncc(c1)Br

STK622543
Synonyms: ethyl1- {[2- (1H- pyrrol- 1- yl)- 1,3- benzothiazol- 6- yl]carbonyl}piperidine- 3- carboxylate
Smiles: CCOC(=O)C1CCCN(C1)C(=O)c1ccc2c(c1)sc(n2)n1cccc1

STK622545
Synonyms: 2- [(5E)- 5- (4- fluorobenzylidene)- 4- oxo- 2- thioxo- 1,3- thiazolidin- 3- yl]- N- [(3S,4R)- 4- hydroxytetrahydrothiophen- 3- yl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C/c2ccc(cc2)F)/C1=O)N[C@@H]1CSC[C@@H]1O

STK622547
Synonyms: N- [3- (acetylamino)phenyl]- 2- [(2- methyl- 4- oxo- 3- phenyl- 4H- chromen- 7- yl)oxy]acetamide
Smiles: O=C(Nc1cccc(c1)NC(=O)C)COc1ccc2c(c1)oc(c(c2=O)c1ccccc1)C

STK622549
Synonyms: 3- amino- N- [(2Z)- 4- phenyl- 1,3- thiazol- 2(3H)- ylidene]thieno[2,3- b]pyridine- 2- carboxamide
Smiles: O=C(c1sc2c(c1N)cccn2)/N=c/1\scc([nH]1)c1ccccc1

STK622550
Synonyms: ethyl[3- (2- methoxyphenyl)- 5,5- dioxido- 2- thioxohexahydro- 1H- thieno[3,4- d]imidazol- 1- yl]acetate
Smiles: CCOC(=O)CN1C2CS(=O)(=O)CC2N(C1=S)c1ccccc1OC

STK622551
Synonyms: 4- (1H- benzimidazol- 2- yl)- 5- imino- 1- {[(E)- pyridin- 4- ylmethylidene]amino}- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2nc3c([nH]2)cccc3)C(=N)N(C1)/N=C/c1ccncc1

STK622552
Synonyms: ethyl7- (3- chlorophenyl)- 2- hydroxy- 5- oxo- 5,6,7,8- tetrahydroquinoline- 3- carboxylate
Smiles: CCOC(=O)c1cc2C(=O)CC(Cc2nc1O)c1cccc(c1)Cl

STK856422
Synonyms: 3,3'- (pyridin- 4- ylmethanediyl)bis(6- methylpyridine- 2,4- diol)
Smiles: Cc1cc(O)c(c(n1)O)C(c1c(O)cc(nc1O)C)c1ccncc1

STK856423
Synonyms: 5- (benzyloxy)- 4- oxo- 2- phenyl- 4H- chromen- 7- yldimethylcarbamate
Smiles: CN(C(=O)Oc1cc(OCc2ccccc2)c2c(c1)oc(cc2=O)c1ccccc1)C

STK622554
Synonyms: (3E)- 3- (3,4- dihydroxybenzylidene)- 1- (naphthalen- 2- yl)pyrrolidine- 2,5- dione
Smiles: O=C1C/C(=C\c2ccc(c(c2)O)O)/C(=O)N1c1ccc2c(c1)cccc2

STK622560
Synonyms: (5Z)- 5- [(1- {4- [(4- fluorobenzyl)oxy]phenyl}- 2,5- dimethyl- 1H- pyrrol- 3- yl)methylidene]- 4- hydroxy- 1,3- thiazol- 2(5H)- one
Smiles: O=C1S/C(=C\c2cc(n(c2C)c2ccc(cc2)OCc2ccc(cc2)F)C)/C(=N1)O

STK622562
Synonyms: 1- [3- (7- methoxy- 4,8- dimethyl- 2- oxo- 2H- chromen- 3- yl)propanoyl]piperidine- 3- carboxylicacid
Smiles: COc1ccc2c(c1C)oc(=O)c(c2C)CCC(=O)N1CCCC(C1)C(=O)O

STK856424
Synonyms: (2Z)- 2- [(5- methylfuran- 2- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- chlorobenzenesulfonate
Smiles: Clc1ccc(cc1)S(=O)(=O)Oc1ccc2c(c1)O/C(=C\c1ccc(o1)C)/C2=O

STK622563
Synonyms: N- [2- (5- chloro- 1H- indol- 3- yl)ethyl]- 1- (2- chloro- 7H- purin- 6- yl)piperidine- 3- carboxamide
Smiles: Clc1ccc2c(c1)c(CCNC(=O)C1CCCN(C1)c1nc(Cl)nc3c1[nH]cn3)c[nH]2

STK622565
Synonyms: 5,6- dimethyl- 7- [2- (morpholin- 4- yl)ethyl]- N- (pyridin- 2- ylmethyl)- 7H- pyrrolo[2,3- d]pyrimidin- 4- amine
Smiles: Cc1c(C)n(c2c1c(ncn2)NCc1ccccn1)CCN1CCOCC1

STK622566
Synonyms: (4E)- 1- [2- (diethylamino)ethyl]- 4- [hydroxy(5- methylfuran- 2- yl)methylidene]- 5- (pyridin- 2- yl)pyrrolidine- 2,3- dione
Smiles: CCN(CCN1C(=O)C(=O)/C(=C(\c2ccc(o2)C)/O)/C1c1ccccn1)CC

STK622567
Synonyms: N- ({1- [(4- fluorophenyl)sulfonyl]piperidin- 4- yl}carbonyl)- L- phenylalanine
Smiles: OC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCN(CC1)S(=O)(=O)c1ccc(cc1)F

STK856425
Synonyms: 4- [(Z)- (6- ethoxy- 3- oxo- 1- benzofuran- 2(3H)- ylidene)methyl]- 2- methoxyphenylmorpholine- 4- carboxylate
Smiles: CCOc1ccc2c(c1)O/C(=C\c1ccc(c(c1)OC)OC(=O)N1CCOCC1)/C2=O

STK622579
Synonyms: 4- (1H- indol- 2- ylcarbonyl)- N- {(2S)- 1- [(4- methoxyphenyl)amino]- 3- methyl- 1- oxobutan- 2- yl}piperazine- 1- carboxamide
Smiles: COc1ccc(cc1)NC(=O)[C@H](C(C)C)NC(=O)N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2

STK622582
Synonyms: {2- [5- hydroxy- 4- methyl- 4- (propan- 2- yl)- 4H- imidazol- 2- yl]quinolin- 3- yl}[4- (3- methoxyphenyl)piperazin- 1- yl]methanone
Smiles: COc1cccc(c1)N1CCN(CC1)C(=O)c1cc2ccccc2nc1C1=NC(C(=N1)O)(C)C(C)C

STK622583
Synonyms: N- [2- (1H- indol- 3- yl)ethyl]- N~3~- pyrimidin- 2- yl- beta- alaninamide
Smiles: O=C(CCNc1ncccn1)NCCc1c[nH]c2c1cccc2

STK622585
Synonyms: N- methyl- 2- [2- (4- methylpiperazin- 1- yl)ethyl]piperidine- 1- carbothioamide
Smiles: CNC(=S)N1CCCCC1CCN1CCN(CC1)C

STK622586
Synonyms: N- {[3- (4- chlorophenyl)- 1,2,4- oxadiazol- 5- yl]methyl}- 2- methylquinoline- 4- carboxamide
Smiles: Clc1ccc(cc1)c1noc(n1)CNC(=O)c1cc(C)nc2c1cccc2

STK622589
Synonyms: 2- (7- hydroxy- 5- methyl[1,2,4]triazolo[1,5- a]pyrimidin- 2- yl)- N- {[3- (4- methoxyphenyl)- 1,2,4- oxadiazol- 5- yl]methyl}acetamide
Smiles: COc1ccc(cc1)c1noc(n1)CNC(=O)Cc1nn2c(n1)nc(cc2O)C

STK622590
Synonyms: N~6~- (naphthalen- 1- yl)- 7H- purine- 2,6- diamine
Smiles: Nc1nc(Nc2cccc3c2cccc3)c2c(n1)nc[nH]2

STK856428
Synonyms: (2Z)- 2- (4- ethoxybenzylidene)- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yldimethylcarbamate
Smiles: CCOc1ccc(cc1)/C=C/1\Oc2c(C1=O)ccc(c2)OC(=O)N(C)C

STK622593
Synonyms: N- [2- (1H- imidazol- 5- yl)ethyl]- 5,6- dimethoxy- 1- methyl- 1H- indole- 2- carboxamide
Smiles: COc1cc2c(cc1OC)cc(n2C)C(=O)NCCc1cnc[nH]1

STK622595
Synonyms: 4- {[2- (furan- 2- yl)ethyl]amino}tetrahydrothiophene- 3- ol1,1- dioxide
Smiles: OC1CS(=O)(=O)CC1NCCc1ccco1

STK622596
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (3- methoxyphenyl)- N- [2- (morpholin- 4- yl)ethyl]- 1,3- oxazol- 5- amine
Smiles: COc1cccc(c1)c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NCCN1CCOCC1

STK622599
Synonyms: [2,5- dioxo- 3- (2- phenylethyl)imidazolidin- 4- yl]aceticacid
Smiles: OC(=O)CC1C(=O)NC(=O)N1CCc1ccccc1

STK622602
Synonyms: 1- (3- chloro- 4- fluorophenyl)- 5- imino- 4- (4- phenyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: OC1=C(c2scc(n2)c2ccccc2)C(=N)N(C1)c1ccc(c(c1)Cl)F

STK622604
Synonyms: 8- {[2- (dimethylamino)ethyl]amino}- 3,3- dimethyl- 6- (phenylamino)- 3,4- dihydro- 1H- pyrano[3,4- c]pyridine- 5- carbonitrile
Smiles: N#Cc1c(Nc2ccccc2)nc(c2c1CC(C)(C)OC2)NCCN(C)C

STK856430
Synonyms: N- (4- {[2- methyl- 7- (trifluoromethyl)quinolin- 4- yl]amino}phenyl)acetamide
Smiles: CC(=O)Nc1ccc(cc1)Nc1cc(C)nc2c1ccc(c2)C(F)(F)F

STK622608
Synonyms: N- [3- (1H- benzimidazol- 2- yl)- 1- (3- methoxypropyl)- 4,5- dimethyl- 1H- pyrrol- 2- yl]- 4- methylbenzamide
Smiles: COCCCn1c(C)c(c(c1NC(=O)c1ccc(cc1)C)c1nc2c([nH]1)cccc2)C

STK622609
Synonyms: 2- (5- ethoxy- 1- ethyl- 1H- indol- 3- yl)ethanamine
Smiles: NCCc1cn(c2c1cc(OCC)cc2)CC

STK622613
Synonyms: 4- [4- (3,4- dimethoxyphenyl)- 1,3- thiazol- 2- yl]- 1- (furan- 2- ylmethyl)- 5- imino- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: COc1cc(ccc1OC)c1csc(n1)C1=C(O)CN(C1=N)Cc1ccco1

STK622614
Synonyms: 3- (2,3- dimethoxybenzyl)- 3,4- dihydro- 2H- 1,2- benzothiazin- 4- ol1,1- dioxide
Smiles: COc1c(cccc1OC)CC1NS(=O)(=O)c2c(C1O)cccc2

STK622616
Synonyms: 2- [2- (4- methylpiperazin- 1- yl)ethyl]- N- phenylpiperidine- 1- carboxamide
Smiles: CN1CCN(CC1)CCC1CCCCN1C(=O)Nc1ccccc1

STK622620
Synonyms: 1- cyclohexyl- 5- imino- 4- (4- methyl- 1,3- thiazol- 2- yl)- 2,5- dihydro- 1H- pyrrol- 3- ol
Smiles: Cc1csc(n1)C1=C(O)CN(C1=N)C1CCCCC1

STK622622
Synonyms: 6- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 7H- purine
Smiles: C1Oc2c(O1)cc(cc2)CN1CCN(CC1)c1ncnc2c1[nH]cn2

STK622624
Synonyms: N- [2- (6- ethyl- 2- oxo- 2H- chromen- 4- yl)- 1- benzofuran- 3- yl]- 2- methylbenzamide
Smiles: CCc1ccc2c(c1)c(cc(=O)o2)c1oc2c(c1NC(=O)c1ccccc1C)cccc2

STK622625
Synonyms: 2- [4- (4- fluorophenyl)piperazin- 1- yl]- 6- (4- methoxyphenyl)pyrimidin- 4- ol
Smiles: COc1ccc(cc1)c1cc(O)nc(n1)N1CCN(CC1)c1ccc(cc1)F

STK856432
Synonyms: (2Z)- 6- (2- oxopropoxy)- 2- [4- (propan- 2- yl)benzylidene]- 1- benzofuran- 3(2H)- one
Smiles: CC(=O)COc1ccc2c(c1)O/C(=C\c1ccc(cc1)C(C)C)/C2=O

STK622629
Synonyms: (2Z)- 2- [(6- chloro- 4H- 1,3- benzodioxin- 8- yl)methylidene]- 6- [(3- chlorobenzyl)oxy]- 1- benzofuran- 3(2H)- one
Smiles: Clc1cc(/C=C/2\Oc3c(C2=O)ccc(c3)OCc2cccc(c2)Cl)c2c(c1)COCO2

STK622638
Synonyms: 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (3,5- dimethoxyphenyl)acetamide
Smiles: COc1cc(NC(=O)CSc2nc(Cl)nc3c2[nH]cn3)cc(c1)OC

STK622640
Synonyms: 2- (2- bromophenyl)- 8,9- dimethyl- 7- (pyridin- 2- ylmethyl)- 7H- pyrrolo[3,2- e][1,2,4]triazolo[1,5- c]pyrimidine
Smiles: Brc1ccccc1c1nn2c(n1)c1c(nc2)n(c(c1C)C)Cc1ccccn1

STK622642
Synonyms: 4- (1H- indol- 2- ylcarbonyl)- N- [(2S)- 1- oxo- 1- (pyrrolidin- 1- yl)propan- 2- yl]piperazine- 1- carboxamide
Smiles: O=C(N1CCN(CC1)C(=O)c1cc2c([nH]1)cccc2)N[C@H](C(=O)N1CCCC1)C

STK622644
Synonyms: (2E)- 2- [(1- ethyl- 1H- indol- 3- yl)methylidene]- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- fluorobenzoate
Smiles: CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2)OC(=O)c1ccc(cc1)F

STK622645
Synonyms: 4- (2- methoxyphenyl)- 2- [3- methyl- 5- (3,4,5- trimethoxyphenyl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 1,3- thiazole
Smiles: COc1cc(cc(c1OC)OC)C1CC(=NN1c1scc(n1)c1ccccc1OC)C

STK622646
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- yl4- methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1ccc2c(c1C)O/C(=C/c1cn(c3c1cc(OC)cc3)C)/C2=O

STK622647
Synonyms: 3- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (6- methylheptan- 2- yl)propanamide
Smiles: CC(CCCC(NC(=O)CCSc1nc(Cl)nc2c1[nH]cn2)C)C

STK622651
Synonyms: N- (1H- benzimidazol- 2- yl)- 2- {(1E)- 5- fluoro- 2- methyl- 1- [4- (methylsulfinyl)benzylidene]- 1H- inden- 3- yl}acetamide
Smiles: Fc1ccc2c(c1)C(=C(/C/2=C\c1ccc(cc1)S(=O)C)C)CC(=O)Nc1nc2c([nH]1)cccc2

STK622652
Synonyms: N- [(2S)- 1- hydroxy- 3- phenylpropan- 2- yl]- 2- (1H- pyrrol- 1- yl)- 1,3- benzothiazole- 6- carboxamide
Smiles: OC[C@@H](NC(=O)c1ccc2c(c1)sc(n2)n1cccc1)Cc1ccccc1

STK622655
Synonyms: N- [2- (2,4- dichlorophenyl)ethyl]- 7H- purin- 6- amine
Smiles: Clc1ccc(c(c1)Cl)CCNc1ncnc2c1[nH]cn2

STK856434
Synonyms: 3- (1,3- benzothiazol- 2- yl)- 2,8- dimethyl- 4- oxo- 4H- chromen- 7- ylacetate
Smiles: CC(=O)Oc1ccc2c(c1C)oc(c(c2=O)c1nc2c(s1)cccc2)C

STK856435
Synonyms: (2Z)- 8- (pyridin- 4- ylmethyl)- 2- (2,3,4- trimethoxybenzylidene)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1c(ccc(c1OC)OC)/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccncc1

STK622657
Synonyms: 5- methoxy- 2- [(4- methoxyphenyl)(4- methylpiperazin- 1- yl)methyl]naphthalen- 1- ol
Smiles: COc1ccc(cc1)C(c1ccc2c(c1O)cccc2OC)N1CCN(CC1)C

STK622660
Synonyms: 1,3- diphenyl- 1H- thieno[2,3- c]pyrazole- 5- carboxamide
Smiles: NC(=O)c1sc2c(c1)c(nn2c1ccccc1)c1ccccc1

STK622664
Synonyms: N- (3- chlorophenyl)- 4- (8,9- dimethylthieno[3,2- e][1,2,4]triazolo[1,5- c]pyrimidin- 5- yl)piperazine- 1- carboxamide
Smiles: Clc1cccc(c1)NC(=O)N1CCN(CC1)c1nc2sc(c(c2c2n1ncn2)C)C

STK622667
Synonyms: (3Z)- 3- (1H- indol- 3- ylmethylidene)- 1- (2- phenylethyl)pyrrolidine- 2,5- dione
Smiles: O=C1C/C(=C/c2c[nH]c3c2cccc3)/C(=O)N1CCc1ccccc1

STK622669
Synonyms: (3R)- 5- oxo- N- [4- (trifluoromethoxy)phenyl]- 2,3,5,9b- tetrahydro[1,3]thiazolo[2,3- a]isoindole- 3- carboxamide
Smiles: O=C([C@@H]1CSC2N1C(=O)c1c2cccc1)Nc1ccc(cc1)OC(F)(F)F

STK622670
Synonyms: (2E)- 2- [(1- ethyl- 5- methoxy- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylacetate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OC(=O)C)cn2CC

STK622675
Synonyms: 2- (6,6- dimethyl- 4- oxo- 5,8- dihydro- 4H- pyrano[4',3':4,5]thieno[2,3- d][1,2,3]triazin- 3(6H)- yl)- N,N- diphenylacetamide
Smiles: O=C(N(c1ccccc1)c1ccccc1)Cn1nnc2c(c1=O)c1CC(C)(C)OCc1s2

STK622676
Synonyms: N- (3- {[(1,3- dimethyl- 2,6- dioxo- 1,2,3,6- tetrahydropyrimidin- 4- yl)methyl]amino}- 3- oxopropyl)- 1H- indole- 5- carboxamide
Smiles: O=C(NCc1cc(=O)n(c(=O)n1C)C)CCNC(=O)c1ccc2c(c1)cc[nH]2

STK622677
Synonyms: 2- [(1'- acetyl- 4- oxo- 3,4- dihydrospiro[chromene- 2,4'- piperidin]- 7- yl)oxy]- N- (1,1- dioxidotetrahydrothiophen- 3- yl)acetamide
Smiles: O=C(NC1CCS(=O)(=O)C1)COc1ccc2c(c1)OC1(CC2=O)CCN(CC1)C(=O)C

STK622680
Synonyms: N- [(5E)- 4- oxo- 5- (quinoxalin- 2- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]pyridine- 3- carboxamide
Smiles: O=C(c1cccnc1)NN1C(=S)S/C(=C/c2cnc3c(n2)cccc3)/C1=O

STK622683
Synonyms: 3- methyl- 2- [(5E)- 4- oxo- 5- (quinoxalin- 6- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]butanoicacid
Smiles: CC(C(N1C(=S)S/C(=C/c2ccc3c(c2)nccn3)/C1=O)C(=O)O)C

STK622684
Synonyms: N- [2- (2- fluorophenyl)ethyl]- 1- (1H- indol- 3- ylacetyl)piperidine- 3- carboxamide
Smiles: O=C(C1CCCN(C1)C(=O)Cc1c[nH]c2c1cccc2)NCCc1ccccc1F

STK622685
Synonyms: 4- (2,3- dihydro- 1,4- benzodioxin- 6- ylsulfonyl)- 2- (2- fluorophenyl)- N- (pyridin- 3- ylmethyl)- 1,3- oxazol- 5- amine
Smiles: Fc1ccccc1c1oc(c(n1)S(=O)(=O)c1ccc2c(c1)OCCO2)NCc1cccnc1

STK622686
Synonyms: 8- {[(1,1- dioxidotetrahydrothiophen- 3- yl)ammonio]methyl}- 3- (2- methoxy- 2- oxoethyl)- 4- methyl- 2- oxo- 2H- chromen- 7- olate
Smiles: COC(=O)Cc1c(=O)oc2c(c1C)ccc(c2C[NH2+]C1CCS(=O)(=O)C1)[O-]

STK622688
Synonyms: 3- [3- (4- acetylpiperazin- 1- yl)- 3- oxopropyl]- 7- methoxy- 4- methyl- 2H- chromen- 2- one
Smiles: COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)N1CCN(CC1)C(=O)C

STK622690
Synonyms: 4- {3- [(Z)- (4- hydroxy- 2- oxo- 1,3- thiazol- 5(2H)- ylidene)methyl]- 2,5- dimethyl- 1H- pyrrol- 1- yl}- 3- methylbenzoicacid
Smiles: O=C1S/C(=C\c2cc(n(c2C)c2ccc(cc2C)C(=O)O)C)/C(=N1)O

STK856443
Synonyms: (2R,3R)- 2- (2,4- dimethoxyphenyl)- 1- ethyl- N- methyl- 5- oxopyrrolidine- 3- carboxamide
Smiles: CCN1C(=O)C[C@H]([C@@H]1c1ccc(cc1OC)OC)C(=O)NC

STK622694
Synonyms: 2- {[3- (4- methoxyphenyl)- 4- oxo- 4H- chromen- 7- yl]oxy}- N- (1,3- thiazol- 2- yl)acetamide
Smiles: COc1ccc(cc1)c1coc2c(c1=O)ccc(c2)OCC(=O)Nc1nccs1

STK622695
Synonyms: 5- [2- (5- methoxy- 1H- indol- 3- yl)ethyl]- 3- methyl- 4- phenyl- 4,5- dihydropyrrolo[3,4- c]pyrazol- 6(2H)- one
Smiles: COc1ccc2c(c1)c(CCN1C(=O)c3c(C1c1ccccc1)c([nH]n3)C)c[nH]2

STK622696
Synonyms: N- (1,1- dioxidotetrahydrothiophen- 3- yl)- N~3~- (5- nitropyridin- 2- yl)- beta- alaninamide
Smiles: O=C(NC1CCS(=O)(=O)C1)CCNc1ccc(cn1)[N+](=O)[O-]

STK622697
Synonyms: N- [3- (5,7- dimethyl- 1,3- benzoxazol- 2- yl)- 4- hydroxyphenyl]- 2- (2- nitrophenoxy)acetamide
Smiles: O=C(Nc1ccc(c(c1)c1nc2c(o1)c(C)cc(c2)C)O)COc1ccccc1[N+](=O)[O-]

STK622700
Synonyms: (5E)- 6- hydroxy- 5- [(3- methyl- 5- oxo- 1- phenyl- 4,5- dihydro- 1H- pyrazol- 4- yl)methylidene]- 2- sulfanylpyrimidin- 4(5H)- one
Smiles: SC1=NC(=O)/C(=C/C2C(=NN(C2=O)c2ccccc2)C)/C(=N1)O

STK622701
Synonyms: N- benzyl- 1- (1,1- dioxidotetrahydrothiophen- 3- yl)- N- methyl- 4,5,6,7- tetrahydro- 1H- indazole- 3- carboxamide
Smiles: CN(C(=O)c1nn(c2c1CCCC2)C1CCS(=O)(=O)C1)Cc1ccccc1

STK622704
Synonyms: 2- [1- (4- phenoxybutyl)piperidin- 4- yl]- 1,3- benzothiazole
Smiles: C(COc1ccccc1)CCN1CCC(CC1)c1nc2c(s1)cccc2

STK622706
Synonyms: methyl(5E)- 5- (1- aminooctadecylidene)- 2,2- dimethyl- 4,6- dioxocyclohexanecarboxylate
Smiles: CCCCCCCCCCCCCCCCC/C(=C\1/C(=O)CC(C(C1=O)C(=O)OC)(C)C)/N

STK622707
Synonyms: N'- [7- (1,3- benzothiazol- 2- yl)- 5,6- dimethyl- 7H- pyrrolo[2,3- d]pyrimidin- 4- yl]- N,N- dimethylpropane- 1,3- diamine
Smiles: CN(CCCNc1ncnc2c1c(C)c(n2c1nc2c(s1)cccc2)C)C

STK622708
Synonyms: ethyl4- {[(2,2- dimethyl- 4- oxo- 3,4- dihydro- 2H- chromen- 7- yl)oxy]acetyl}piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)COc1ccc2c(c1)OC(CC2=O)(C)C

STK622709
Synonyms: 5- (biphenyl- 4- yl)- 2- hydroxy- 1- (tetrahydrofuran- 2- ylmethyl)pyrido[2,3- d]pyrimidin- 4(1H)- one
Smiles: Oc1nc(=O)c2c(n1CC1CCCO1)nccc2c1ccc(cc1)c1ccccc1

STK622711
Synonyms: 2- methyl- N- [(5Z)- 4- oxo- 5- (quinoxalin- 5- ylmethylidene)- 2- thioxo- 1,3- thiazolidin- 3- yl]furan- 3- carboxamide
Smiles: S=C1S/C(=C\c2cccc3c2nccn3)/C(=O)N1NC(=O)c1ccoc1C

STK622713
Synonyms: 1- (2- chlorophenyl)- 3- methyl- 4- (thiophen- 3- yl)- 4,5- dihydro- 1H- pyrazolo[3,4- b]pyridin- 6- ol
Smiles: OC1=Nc2c(C(C1)c1ccsc1)c(nn2c1ccccc1Cl)C

STK622714
Synonyms: 2- ethyl- 3- (4- methoxyphenyl)- 5- methyl- 6- (prop- 2- en- 1- yl)pyrazolo[1,5- a]pyrimidin- 7- ol
Smiles: C=CCc1c(C)nc2n(c1O)nc(c2c1ccc(cc1)OC)CC

STK622717
Synonyms: methyl{2- [4- (1,3- benzodioxol- 5- ylmethyl)piperazin- 1- yl]- 6- hydroxypyrimidin- 4- yl}acetate
Smiles: COC(=O)Cc1cc(O)nc(n1)N1CCN(CC1)Cc1ccc2c(c1)OCO2

STK622718
Synonyms: N- (4- carboxy- 4- hydroxybutanoyl)- S- (6- ethoxy- 2- methylquinolin- 4- yl)cysteinylglycine
Smiles: CCOc1ccc2c(c1)c(SCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)O)cc(n2)C

STK622721
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 6- {[(2E)- 3- phenylprop- 2- en- 1- yl]oxy}- 1- benzofuran- 3(2H)- one
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OC/C=C/c1ccccc1)cn2C

STK622727
Synonyms: 4- [3- (3- methoxyphenyl)- 5- (quinoxalin- 6- yl)- 4,5- dihydro- 1H- pyrazol- 1- yl]- 4- oxobutanoicacid
Smiles: COc1cccc(c1)C1=NN(C(C1)c1ccc2c(c1)nccn2)C(=O)CCC(=O)O

STK622730
Synonyms: N- (5- chloropyridin- 2- yl)- N'- (pyridin- 2- ylmethyl)ethanediamide
Smiles: Clc1ccc(nc1)NC(=O)C(=O)NCc1ccccn1

STK622731
Synonyms: 2- (morpholin- 4- yl)- N- (2- phenylethyl)- 7,8- dihydro- 6H- thiopyrano[3,2- d]pyrimidin- 4- amine
Smiles: O1CCN(CC1)c1nc(NCCc2ccccc2)c2c(n1)CCCS2

STK622735
Synonyms: 3- (2- methoxyphenyl)- 2- methyl- 9- [2- (morpholin- 4- yl)ethyl]- 9,10- dihydro- 4H,8H- chromeno[8,7- e][1,3]oxazin- 4- one
Smiles: COc1ccccc1c1c(C)oc2c(c1=O)ccc1c2CN(CCN2CCOCC2)CO1

STK622740
Synonyms: 2- [(2- chloro- 7H- purin- 6- yl)sulfanyl]- N- (4- methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)CSc1nc(Cl)nc2c1[nH]cn2

STK622743
Synonyms: 6- (3- bromo- 4- fluorophenyl)- 3- (2- phenylethyl)[1,2,4]triazolo[3,4- b][1,3,4]thiadiazole
Smiles: Fc1ccc(cc1Br)c1nn2c(s1)nnc2CCc1ccccc1

STK622745
Synonyms: (3Z)- 6- chloro- 1- [(dimethylamino)methyl]- 3- (pyridin- 3- ylmethylidene)- 1,3- dihydro- 2H- indol- 2- one
Smiles: CN(CN1C(=O)/C(=C\c2cccnc2)/c2c1cc(Cl)cc2)C

STK622746
Synonyms: (2E)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 7- methyl- 3- oxo- 2,3- dihydro- 1- benzofuran- 6- ylmethanesulfonate
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OS(=O)(=O)C)cn2C

STK856448
Synonyms: (2E)- 3- (1- benzofuran- 2- yl)- 1- (2- hydroxyphenyl)prop- 2- en- 1- one
Smiles: O=C(c1ccccc1O)/C=C/c1cc2c(o1)cccc2

STK622749
Synonyms: (2E)- 6- (benzyloxy)- 2- [(5- methoxy- 1- methyl- 1H- indol- 3- yl)methylidene]- 1- benzofuran- 3(2H)- one
Smiles: COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OCc1ccccc1)cn2C

STK622753
Synonyms: (2Z)- 2- (pyridin- 4- ylmethylidene)- 8- (tetrahydrofuran- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: O=C1/C(=C/c2ccncc2)/Oc2c1ccc1c2CN(CO1)CC1CCCO1

STK622754
Synonyms: ethyl4- (4- fluorophenyl)- 2- (morpholin- 4- yl)- 6- oxo- 1,4,5,6- tetrahydropyrimidine- 5- carboxylate
Smiles: CCOC(=O)C1C(=O)NC(=NC1c1ccc(cc1)F)N1CCOCC1

STK622756
Synonyms: N- cyclohexyl- 2- [(9- oxo- 1,2,3,9- tetrahydropyrrolo[2,1- b]quinazolin- 7- yl)oxy]acetamide
Smiles: O=C(NC1CCCCC1)COc1ccc2c(c1)c(=O)n1c(n2)CCC1

STK622758
Synonyms: N- (2- hydroxy- 2- phenylethyl)- 3- {4- methyl- 7- [(2- methylprop- 2- en- 1- yl)oxy]- 2- oxo- 2H- chromen- 3- yl}propanamide
Smiles: CC(=C)COc1ccc2c(c1)oc(=O)c(c2C)CCC(=O)NCC(c1ccccc1)O

STK622760
Synonyms: (2Z)- 2- (2,4- dimethoxybenzylidene)- 8- (pyridin- 2- ylmethyl)- 8,9- dihydro- 7H- furo[2,3- f][1,3]benzoxazin- 3(2H)- one
Smiles: COc1cc(OC)ccc1/C=C/1\Oc2c(C1=O)ccc1c2CN(CO1)Cc1ccccn1

STK622761
Synonyms: ethyl4- ({2- [5- hydroxy- 4- methyl- 4- (propan- 2- yl)- 4H- imidazol- 2- yl]quinolin- 3- yl}carbonyl)piperazine- 1- carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)c1cc2ccccc2nc1C1=NC(C(=N1)O)(C)C(C)C

STK622762
Synonyms: 1- [3- (7- hydroxy- 4,8- dimethyl- 2- oxo- 2H- chromen- 3- yl)propanoyl]piperidine- 2- carboxylicacid
Smiles: OC(=O)C1CCCCN1C(=O)CCc1c(=O)oc2c(c1C)ccc(c2C)O

©2018 Vitas M Chemical Limited