Vitas-M small molecule compound

ethyl 2-{[(3-chlorophenyl)carbonyl]amino}-4-methyl-5-[(2-methylphenyl)carbamoyl]thiophene-3-carboxylate

Catalog ID
STK044068
SMILES CCOC(=O)c1c(NC(=O)c2cccc(c2)Cl)sc(c1C)C(=O)Nc1ccccc1C

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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/c1-4-30-23(29)18-14(3)19(21(28)25-17-11-6-5-8-13(17)2)31-22(18)26-20(27)15-9-7-10-16(24)12-15/h5-12H,4H2,1-3H3,(H,25,28)(H,26,27)
InChIKey
JVWOWSCVJIUAJU-UHFFFAOYSA-N
Synonyms
312587-33-0
312587330
CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2C)NC(=O)C3=CC(=CC=C3)Cl
CCOC(=O)c1c(NC(=O)c2cccc(c2)Cl)sc(c1C)C(=O)Nc1ccccc1C
ETHYL2(((3CHLOROPHENYL)CARBONYL)AMINO)4METHYL5((2METHYLPHENYL)CARBAMOYL)THIOPHENE3CARBOXYLATE
ETHYL2((3CHLOROBENZOYL)AMINO)4METHYL5((2METHYLPHENYL)CARBAMOYL)THIOPHENE3CARBOXYLATE
ETHYL2((3CHLOROBENZOYL)AMINO)4METHYL5(2TOLUIDINOCARBONYL)3THIOPHENECARBOXYLATE
InChI=1SC23H21ClN2O4Sc143023(29)1814(3)19(21(28)25171165813(17)2)3122(18)2620(27)15971016(24)1215h512H4H213H3(H2528)(H2627)
MFCD01151616
STK044068
ZINC000000647574
ZINC00647574
ZINC647574

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Available files

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