Vitas-M small molecule compound
methyl 4-[(5E)-5-(2-chloro-6-fluorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]benzoate
Catalog ID
STK842980
SMILES COC(=O)c1ccc(cc1)N1C(=S)S/C(=C/c2c(F)cccc2Cl)/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 C18H11ClFNO3S2 MW 407.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11ClFNO3S2/c1-24-17(23)10-5-7-11(8-6-10)21-16(22)15(26-18(21)25)9-12-13(19)3-2-4-14(12)20/h2-9H,1H3/b15-9+InChIKey
ADGUPMZZNOUWPR-OQLLNIDSSA-NSynonyms
433309-70-7(E)METHYL4(5(2CHLORO6FLUOROBENZYLIDENE)4OXO2THIOXOTHIAZOLIDIN3YL)BENZOATE
433309707
COC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC=C3Cl)F)SC2=S
COC(=O)c1ccc(cc1)N1C(=S)SC(=Cc2c(F)cccc2Cl)C1=O
InChI=1SC18H11ClFNO3S2c12417(23)105711(8610)2116(22)15(2618(21)25)91213(19)32414(12)20h29H1H3b159+
METHYL4((5E)5((2CHLORO6FLUOROPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BENZOATE
methyl4((5E)5(2chloro6fluorobenzylidene)4oxo2thioxo13thiazolidin3yl)benzoate
METHYL4(5((6CHLORO2FLUOROPHENYL)METHYLENE)4OXO2THIOXO13THIAZOLIDIN3YL)BENZOATE
MFCD02960331
ZINC000004482823
ZINC04482823
ZINC4482823
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