Vitas-M small molecule compound
methyl (5Z)-2-[(4-fluorophenyl)amino]-4-oxo-5-(thiophen-2-ylmethylidene)-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK158496
SMILES COC(=O)C1=C(Nc2ccc(cc2)F)S/C(=C\c2cccs2)/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 C17H12FNO3S2 MW 361.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12FNO3S2/c1-22-17(21)14-15(20)13(9-12-3-2-8-23-12)24-16(14)19-11-6-4-10(18)5-7-11/h2-9,19H,1H3/b13-9-InChIKey
HLEVFKKBOADRJR-LCYFTJDESA-NSynonyms
COC(=O)C1=C(Nc2ccc(cc2)F)SC(=Cc2cccs2)C1=O
COC(=O)C1=C(SC(=CC2=CC=CS2)C1=O)NC3=CC=C(C=C3)F
InChI=1SC17H12FNO3S2c12217(21)1415(20)13(9123282312)2416(14)19116410(18)5711h2919H1H3b139
METHYL(5Z)2((4FLUOROPHENYL)AMINO)4OXO5(THIOPHEN2YLMETHYLIDENE)45DIHYDROTHIOPHENE3CARBOXYLATE
METHYL(5Z)2(4FLUOROANILINO)4OXO5(THIOPHEN2YLMETHYLIDENE)THIOPHENE3CARBOXYLATE
MFCD06239608
ZINC000001412438
ZINC01412438
ZINC1412438
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