Vitas-M small molecule compound
methyl (5Z)-5-(furan-2-ylmethylidene)-4-oxo-2-{[3-(trifluoromethyl)phenyl]amino}-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK158504
SMILES COC(=O)C1=C(Nc2cccc(c2)C(F)(F)F)S/C(=C\c2ccco2)/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 C18H12F3NO4S MW 395.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12F3NO4S/c1-25-17(24)14-15(23)13(9-12-6-3-7-26-12)27-16(14)22-11-5-2-4-10(8-11)18(19,20)21/h2-9,22H,1H3/b13-9-InChIKey
SWZGYBXGHAANPR-LCYFTJDESA-NSynonyms
COC(=O)C1=C(Nc2cccc(c2)C(F)(F)F)SC(=Cc2ccco2)C1=O
COC(=O)C1=C(SC(=CC2=CC=CO2)C1=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC18H12F3NO4Sc12517(24)1415(23)13(9126372612)2716(14)221152410(811)18(1920)21h2922H1H3b139
METHYL(5Z)5(FURAN2YLMETHYLIDENE)4OXO2((3(TRIFLUOROMETHYL)PHENYL)AMINO)45DIHYDROTHIOPHENE3CARBOXYLATE
METHYL(5Z)5(FURAN2YLMETHYLIDENE)4OXO2(3(TRIFLUOROMETHYL)ANILINO)THIOPHENE3CARBOXYLATE
MFCD06239292
ZINC000004688366
ZINC04688366
ZINC4688366
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