Vitas-M small molecule compound
butyl 4-({3-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)benzoate
Catalog ID
STK837471
SMILES CCCCOC(=O)c1ccc(cc1)NC(=O)CCN1C(=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 C25H26N2O4S2 MW 482.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O4S2/c1-3-4-15-31-24(30)19-9-11-20(12-10-19)26-22(28)13-14-27-23(29)21(33-25(27)32)16-18-7-5-17(2)6-8-18/h5-12,16H,3-4,13-15H2,1-2H3,(H,26,28)/b21-16-InChIKey
ROEMSDAMWGBJMP-PGMHBOJBSA-NSynonyms
(Z)butyl4(3(5(4methylbenzylidene)4oxo2thioxothiazolidin3yl)propanamido)benzoate
butyl4((3((5Z)5(4methylbenzylidene)4oxo2thioxo13thiazolidin3yl)propanoyl)amino)benzoate
BUTYL4(3((5Z)5((4METHYLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOYLAMINO)BENZOATE
CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCN2C(=O)C(=CC3=CC=C(C=C3)C)SC2=S
CCCCOC(=O)c1ccc(cc1)NC(=O)CCN1C(=S)SC(=Cc2ccc(cc2)C)C1=O
InChI=1SC25H26N2O4S2c134153124(30)1991120(121019)2622(28)13142723(29)21(3325(27)32)16187517(2)6818h51216H341315H212H3(H2628)b2116
MFCD02369765
ZINC000008714013
ZINC08714013
ZINC8714013
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