41271325 -OEChem-05112415012D 51 54 0 0 0 0 0 0 0999 V2000 7.7864 1.4578 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2970 -0.6582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6650 2.8427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3903 2.9485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0512 -4.9846 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.3191 -4.9846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1851 -0.4846 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2038 1.1214 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8080 2.2440 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3761 0.1032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1851 -1.4846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6819 0.4633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2092 1.2259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4251 -0.2059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7038 0.2554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9942 0.1032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6851 1.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6851 1.0542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8729 1.8645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8025 2.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3191 -1.9846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0512 -1.9846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 3.1575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 3.9666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3191 -2.9846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0512 -2.9846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1851 -3.4846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 3.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 4.8801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9836 3.8620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.1756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 4.9846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1851 -4.4846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6077 1.0759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2525 0.6074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2962 -0.8123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5838 -0.0884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3207 1.5558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0496 1.5558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7822 -1.6746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5881 -1.6746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4436 1.7424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7822 -3.2946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5881 -3.2946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 2.7605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 5.3817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9188 3.2454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6002 3.7972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0484 4.4786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 4.2404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 5.5510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 19 1 0 0 0 0 2 15 2 0 0 0 0 3 19 2 0 0 0 0 4 20 2 0 0 0 0 5 33 1 0 0 0 0 6 33 2 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 7 16 1 0 0 0 0 8 13 1 0 0 0 0 8 15 1 0 0 0 0 8 19 1 0 0 0 0 9 20 1 0 0 0 0 9 23 1 0 0 0 0 9 42 1 0 0 0 0 10 14 1 0 0 0 0 10 17 2 0 0 0 0 11 21 2 0 0 0 0 11 22 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 20 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 16 18 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 21 25 1 0 0 0 0 21 40 1 0 0 0 0 22 26 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 29 2 0 0 0 0 24 30 1 0 0 0 0 25 27 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 33 1 0 0 0 0 28 31 1 0 0 0 0 28 45 1 0 0 0 0 29 32 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 32 2 0 0 0 0 31 50 1 0 0 0 0 32 51 1 0 0 0 0 M CHG 1 5 -1 M END > 41271325 > 1 > 817 > 6 > 1 > 5 > AAADceB7OABAAAAAAAAAAAAAAAAAAWLAAAAwYAAAAAAAAAAB0AAAHgQQAAAADAjB3gQ+yJPMEAioAzX3XACCgCB1AjAI2CG4bNgIZvLAlbGUMQhk1iHIyYeY2SOeCAAAAAACAAAQAAAAAAQAAAAAAAAAAA== > 4-[2-[(Z)-[3-[2-(2-methylanilino)-2-oxo-ethyl]-2,4-dioxo-thiazolidin-5-ylidene]methyl]pyrrol-1-yl]benzoate > 4-[2-[(Z)-[3-[2-(2-methylanilino)-2-oxoethyl]-2,4-dioxo-5-thiazolidinylidene]methyl]-1-pyrrolyl]benzoate > 4-[2-[(Z)-[3-[2-(2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]pyrrol-1-yl]benzoate > 4-[2-[(Z)-[3-[2-(2-methylanilino)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]pyrrol-1-yl]benzoate > 4-[2-[(Z)-[3-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-2,4-bis(oxidanylidene)-1,3-thiazolidin-5-ylidene]methyl]pyrrol-1-yl]benzoate > 4-[2-[(Z)-[2,4-diketo-3-[2-keto-2-(o-toluidino)ethyl]thiazolidin-5-ylidene]methyl]pyrrol-1-yl]benzoate > InChI=1S/C24H19N3O5S/c1-15-5-2-3-7-19(15)25-21(28)14-27-22(29)20(33-24(27)32)13-18-6-4-12-26(18)17-10-8-16(9-11-17)23(30)31/h2-13H,14H2,1H3,(H,25,28)(H,30,31)/p-1/b20-13- > QEJZXINMLSTCJF-MOSHPQCFSA-M > 4.3 > 460.09671686 > C24H18N3O5S- > 460.5 > CC1=CC=CC=C1NC(=O)CN2C(=O)C(=CC3=CC=CN3C4=CC=C(C=C4)C(=O)[O-])SC2=O > CC1=CC=CC=C1NC(=O)CN2C(=O)/C(=C/C3=CC=CN3C4=CC=C(C=C4)C(=O)[O-])/SC2=O > 137 > 460.09671686 > -1 > 33 > 0 > 0 > 1 > 0 > 0 > 1 > -1 > 1 5 255 > 10 17 8 11 21 8 11 22 8 16 18 8 17 18 8 21 25 8 22 26 8 23 24 8 23 28 8 24 29 8 25 27 8 26 27 8 28 31 8 29 32 8 31 32 8 7 10 8 7 16 8 $$$$