Vitas-M small molecule compound
4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[3-(trifluoromethyl)phenyl]butanamide
Catalog ID
STK836716
SMILES O=C(Nc1cccc(c1)C(F)(F)F)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 C21H16ClF3N2O2S2 MW 484.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClF3N2O2S2/c22-16-8-2-1-5-13(16)11-17-19(29)27(20(30)31-17)10-4-9-18(28)26-15-7-3-6-14(12-15)21(23,24)25/h1-3,5-8,11-12H,4,9-10H2,(H,26,28)/b17-11-InChIKey
PAITTWHQHCNPCS-BOPFTXTBSA-NSynonyms
(Z)4(5(2chlorobenzylidene)4oxo2thioxothiazolidin3yl)N(3(trifluoromethyl)phenyl)butanamide
4((5Z)5((2CHLOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)N(3(TRIFLUOROMETHYL)PHENYL)BUTANAMIDE
4((5Z)5(2chlorobenzylidene)4oxo2thioxo13thiazolidin3yl)N(3(trifluoromethyl)phenyl)butanamide
C1=CC=C(C(=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)NC3=CC=CC(=C3)C(F)(F)F)Cl
InChI=1SC21H16ClF3N2O2S2c2216821513(16)111719(29)27(20(30)3117)104918(28)261573614(1215)21(2324)25h13581112H4910H2(H2628)b1711
MFCD02370029
O=C(Nc1cccc(c1)C(F)(F)F)CCCN1C(=S)SC(=Cc2ccccc2Cl)C1=O
ZINC000002374894
ZINC02374894
ZINC2374894
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