Vitas-M small molecule compound

ethyl 2-{[(4-chlorophenyl)acetyl]amino}-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate

Catalog ID
STK071544
SMILES CCOC(=O)c1c(NC(=O)Cc2ccc(cc2)Cl)sc(c1C)C(=O)Nc1ccccc1

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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 C23H21ClN2O4S MW 456.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN2O4S/c1-3-30-23(29)19-14(2)20(21(28)25-17-7-5-4-6-8-17)31-22(19)26-18(27)13-15-9-11-16(24)12-10-15/h4-12H,3,13H2,1-2H3,(H,25,28)(H,26,27)
InChIKey
ZQRWCNFSYPZRQI-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC(=O)CC3=CC=C(C=C3)Cl
CCOC(=O)c1c(NC(=O)Cc2ccc(cc2)Cl)sc(c1C)C(=O)Nc1ccccc1
ETHYL2(((4CHLOROPHENYL)ACETYL)AMINO)4METHYL5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
ETHYL2((2(4CHLOROPHENYL)ACETYL)AMINO)4METHYL5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
ETHYL2(2(4CHLOROPHENYL)ACETYLAMINO)4METHYL5(NPHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
InChI=1SC23H21ClN2O4Sc133023(29)1914(2)20(21(28)25177546817)3122(19)2618(27)131591116(24)121015h412H313H212H3(H2528)(H2627)
MFCD01825063
STK071544
ZINC000002941467
ZINC02941467
ZINC2941467

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Available files

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