Vitas-M small molecule compound

ethyl 5-[(3-chloro-2-methylphenyl)carbamoyl]-4-methyl-2-[(phenylacetyl)amino]thiophene-3-carboxylate

Catalog ID
STK018807
SMILES CCOC(=O)c1c(NC(=O)Cc2ccccc2)sc(c1C)C(=O)Nc1cccc(c1C)Cl

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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 C24H23ClN2O4S MW 470.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23ClN2O4S/c1-4-31-24(30)20-15(3)21(22(29)26-18-12-8-11-17(25)14(18)2)32-23(20)27-19(28)13-16-9-6-5-7-10-16/h5-12H,4,13H2,1-3H3,(H,26,29)(H,27,28)
InChIKey
DEGNEHDACTZSNB-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C(=CC=C2)Cl)C)NC(=O)CC3=CC=CC=C3
CCOC(=O)c1c(NC(=O)Cc2ccccc2)sc(c1C)C(=O)Nc1cccc(c1C)Cl
ETHYL5((3CHLORO2METHYLPHENYL)CARBAMOYL)4METHYL2((2PHENYLACETYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5((3CHLORO2METHYLPHENYL)CARBAMOYL)4METHYL2((PHENYLACETYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5(N(3CHLORO2METHYLPHENYL)CARBAMOYL)4METHYL2(2PHENYLACETYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC24H23ClN2O4Sc143124(30)2015(3)21(22(29)26181281117(25)14(18)2)3223(20)2719(28)131696571016h512H413H213H3(H2629)(H2728)
MFCD02627456
STK018807
ZINC000002771816
ZINC02771816
ZINC2771816

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Available files

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