Vitas-M small molecule compound
N-(3-chloro-4-methylphenyl)-2-[(5Z)-5-{[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]acetamide
Catalog ID
STL370047
SMILES O=C(CN1C(=O)S/C(=C\c2cccn2c2cccc(c2)[N+](=O)[O-])/C1=O)Nc1ccc(c(c1)Cl)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C23H17ClN4O5S MW 496.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClN4O5S/c1-14-7-8-15(10-19(14)24)25-21(29)13-27-22(30)20(34-23(27)31)12-17-6-3-9-26(17)16-4-2-5-18(11-16)28(32)33/h2-12H,13H2,1H3,(H,25,29)/b20-12-InChIKey
BJAIXZCDTFJRKK-NDENLUEZSA-NSynonyms
CC1=C(C=C(C=C1)NC(=O)CN2C(=O)C(=CC3=CC=CN3C4=CC(=CC=C4)(N+)(=O)(O))SC2=O)Cl
InChI=1SC23H17ClN4O5Sc1147815(1019(14)24)2521(29)132722(30)20(3423(27)31)121763926(17)1642518(1116)28(32)33h212H13H21H3(H2529)b2012
MFCD28950878
N(3chloro4methylphenyl)2((5Z)5((1(3nitrophenyl)1Hpyrrol2yl)methylidene)24dioxo13thiazolidin3yl)acetamide
N(3chloro4methylphenyl)2((5Z)5((1(3nitrophenyl)pyrrol2yl)methylidene)24dioxo13thiazolidin3yl)acetamide
O=C(CN1C(=O)SC(=Cc2cccn2c2cccc(c2)(N+)(=O)(O))C1=O)Nc1ccc(c(c1)Cl)C
ZINC000034931645
ZINC34931645
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