Vitas-M small molecule compound
methyl 4-{[(2E,5Z)-5-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoate
Catalog ID
STL374669
SMILES COC(=O)c1ccc(cc1)/N=C\1/S/C(=C\c2cc(n(c2C)c2ccc(cc2)F)C)/C(=O)N1C
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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 C25H22FN3O3S MW 463.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FN3O3S/c1-15-13-18(16(2)29(15)21-11-7-19(26)8-12-21)14-22-23(30)28(3)25(33-22)27-20-9-5-17(6-10-20)24(31)32-4/h5-14H,1-4H3/b22-14-,27-25+InChIKey
JJNRIDMVWYGKNP-ZQQCWGMFSA-NSynonyms
COC(=O)c1ccc(cc1)N=C1SC(=Cc2cc(n(c2C)c2ccc(cc2)F)C)C(=O)N1C
methyl4(((2E5Z)5((1(4fluorophenyl)25dimethyl1Hpyrrol3yl)methylidene)3methyl4oxo13thiazolidin2ylidene)amino)benzoate
MFCD02954125
ZINC000008438917
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