-ISIS- 08251614582D 34 36 0 0 0 0 0 0 0 0999 V2000 3.1500 4.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 3.1375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 4.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9667 2.9292 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.4708 3.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9625 5.5167 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0667 -4.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2583 -4.0792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0750 -5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 1.1875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8792 -4.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5625 -3.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4708 0.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4708 2.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5667 -3.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9667 1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7208 6.1625 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4708 0.3250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0417 1.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 5.8542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5542 0.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2042 -6.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9667 -0.5333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 0.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0542 -0.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0667 -2.2750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0625 -2.2667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9375 -6.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -1.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9333 4.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4708 3.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5542 -1.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -0.5333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5375 2.0583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 2 0 0 0 0 3 1 1 0 0 0 0 4 5 1 0 0 0 0 5 1 2 0 0 0 0 6 1 1 0 0 0 0 7 8 1 0 0 0 0 8 12 1 0 0 0 0 9 7 1 0 0 0 0 10 18 1 0 0 0 0 11 15 1 0 0 0 0 12 27 1 0 0 0 0 13 16 1 0 0 0 0 14 4 1 0 0 0 0 15 12 2 0 0 0 0 16 14 1 0 0 0 0 17 6 1 0 0 0 0 18 13 1 0 0 0 0 19 10 2 0 0 0 0 20 6 2 0 0 0 0 21 19 1 0 0 0 0 22 9 2 0 0 0 0 23 13 2 0 0 0 0 24 21 2 0 0 0 0 25 21 1 0 0 0 0 26 29 1 0 0 0 0 27 26 1 0 0 0 0 28 9 1 0 0 0 0 29 32 1 0 0 0 0 30 3 1 0 0 0 0 31 5 1 0 0 0 0 32 25 2 0 0 0 0 33 24 1 0 0 0 0 34 19 1 0 0 0 0 2 4 1 0 0 0 0 29 33 2 0 0 0 0 7 11 2 0 0 0 0 M CHG 2 6 1 17 -1 M END > (STL403462) STL403462 > (STL403462) 8 > (STL403462) 2.92 > (STL403462) 164.77 > (STL403462) 2 > (STL403462) 7 > (STL403462) 3 > (STL403462) 5-({4-[(1Z)-1-{2-[3-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinylidene}ethyl]phenoxy}methyl)furan-2-carboxylic acid > (STL403462) 469.45 > (STL403462) C22H23N5O7 > (STL403462) O=C(CCn1nc(c(c1C)[N+](=O)[O-])C)N/N=C(\c1ccc(cc1)OCc1ccc(o1)C(=O)O)/C $$$$