Vitas-M small molecule compound
3-{2-[(Z)-{(2E)-2-[(3,4-dimethylphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]-1H-pyrrol-1-yl}benzoic acid
Catalog ID
STK155187
SMILES OC(=O)c1cccc(c1)n1cccc1/C=C/1\S/C(=N/c2ccc(c(c2)C)C)/NC1=O
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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 C23H19N3O3S MW 417.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O3S/c1-14-8-9-17(11-15(14)2)24-23-25-21(27)20(30-23)13-19-7-4-10-26(19)18-6-3-5-16(12-18)22(28)29/h3-13H,1-2H3,(H,28,29)(H,24,25,27)/b20-13-InChIKey
QSWGNXLABLKGBE-MOSHPQCFSA-NSynonyms
3(2((Z)((2E)2((34DIMETHYLPHENYL)IMINO)4OXO13THIAZOLIDIN5YLIDENE)METHYL)1HPYRROL1YL)BENZOICACID
3(2((Z)(2(34DIMETHYLANILINO)4OXO13THIAZOL5YLIDENE)METHYL)PYRROL1YL)BENZOICACID
CC1=C(C=C(C=C1)NC2=NC(=O)C(=CC3=CC=CN3C4=CC=CC(=C4)C(=O)O)S2)C
InChI=1SC23H19N3O3Sc1148917(1115(14)2)24232521(27)20(3023)1319741026(19)1863516(1218)22(28)29h313H12H3(H2829)(H242527)b2013
MFCD03923535
OC(=O)c1cccc(c1)n1cccc1C=C1SC(=Nc2ccc(c(c2)C)C)NC1=O
ZINC000005532361
ZINC5532361
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