Vitas-M small molecule compound
4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(2-hydroxy-4-nitrophenyl)butanamide
Catalog ID
STK837563
SMILES O=C(Nc1ccc(cc1O)[N+](=O)[O-])CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=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 C20H16ClN3O5S2 MW 477.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN3O5S2/c21-14-5-2-1-4-12(14)10-17-19(27)23(20(30)31-17)9-3-6-18(26)22-15-8-7-13(24(28)29)11-16(15)25/h1-2,4-5,7-8,10-11,25H,3,6,9H2,(H,22,26)/b17-10-InChIKey
KPQNYYOFUSPRNY-YVLHZVERSA-NSynonyms
(Z)4(5(2chlorobenzylidene)4oxo2thioxothiazolidin3yl)N(2hydroxy4nitrophenyl)butanamide
4((5Z)5((2CHLOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)N(2HYDROXY4NITROPHENYL)BUTANAMIDE
4((5Z)5(2chlorobenzylidene)4oxo2thioxo13thiazolidin3yl)N(2hydroxy4nitrophenyl)butanamide
C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)NC3=C(C=C(C=C3)(N+)(=O)(O))O)Cl
InChI=1SC20H16ClN3O5S2c2114521412(14)101719(27)23(20(30)3117)93618(26)22158713(24(28)29)1116(15)25h124578101125H369H2(H2226)b1710
MFCD02370047
O=C(Nc1ccc(cc1O)(N+)(=O)(O))CCCN1C(=S)SC(=Cc2ccccc2Cl)C1=O
ZINC000008714030
ZINC08714030
ZINC8714030
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