Vitas-M small molecule compound

ethyl (5E)-2-[(4-methoxyphenyl)amino]-4-oxo-5-(thiophen-2-ylmethylidene)-4,5-dihydrothiophene-3-carboxylate

Catalog ID
STK158402
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)OC)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 C19H17NO4S2 MW 387.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17NO4S2/c1-3-24-19(22)16-17(21)15(11-14-5-4-10-25-14)26-18(16)20-12-6-8-13(23-2)9-7-12/h4-11,20H,3H2,1-2H3/b15-11+
InChIKey
YDKQHNOKQLJOLW-RVDMUPIBSA-N
Synonyms

CCOC(=O)C1=C(Nc2ccc(cc2)OC)SC(=Cc2cccs2)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=CS2)C1=O)NC3=CC=C(C=C3)OC
ETHYL(5E)2((4METHOXYPHENYL)AMINO)4OXO5(THIOPHEN2YLMETHYLIDENE)45DIHYDROTHIOPHENE3CARBOXYLATE
ETHYL(5E)2(4METHOXYANILINO)4OXO5(THIOPHEN2YLMETHYLIDENE)THIOPHENE3CARBOXYLATE
InChI=1SC19H17NO4S2c132419(22)1617(21)15(111454102514)2618(16)20126813(232)9712h41120H3H212H3b1511+
MFCD08679375
ZINC000004688349
ZINC04688349
ZINC4688349

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.