Vitas-M small molecule compound
N-(2-hydroxy-4-nitrophenyl)-4-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide
Catalog ID
STK837527
SMILES O=C(Nc1ccc(cc1O)[N+](=O)[O-])CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/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 C21H19N3O5S2 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O5S2/c1-13-4-6-14(7-5-13)11-18-20(27)23(21(30)31-18)10-2-3-19(26)22-16-9-8-15(24(28)29)12-17(16)25/h4-9,11-12,25H,2-3,10H2,1H3,(H,22,26)/b18-11-InChIKey
BQXCPZDDFZEMNW-WQRHYEAKSA-NSynonyms
(Z)N(2hydroxy4nitrophenyl)4(5(4methylbenzylidene)4oxo2thioxothiazolidin3yl)butanamide
CC1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)NC3=C(C=C(C=C3)(N+)(=O)(O))O
InChI=1SC21H19N3O5S2c1134614(7513)111820(27)23(21(30)3118)102319(26)22169815(24(28)29)1217(16)25h49111225H2310H21H3(H2226)b1811
MFCD02369917
N(2HYDROXY4NITROPHENYL)4((5Z)5((4METHYLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANAMIDE
N(2hydroxy4nitrophenyl)4((5Z)5(4methylbenzylidene)4oxo2thioxo13thiazolidin3yl)butanamide
O=C(Nc1ccc(cc1O)(N+)(=O)(O))CCCN1C(=S)SC(=Cc2ccc(cc2)C)C1=O
ZINC000008714021
ZINC08714021
ZINC8714021
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