Vitas-M small molecule compound

methyl 5-(dimethylcarbamoyl)-4-methyl-2-[(trichloroacetyl)amino]thiophene-3-carboxylate

Catalog ID
STK440679
SMILES COC(=O)c1c(sc(c1C)C(=O)N(C)C)NC(=O)C(Cl)(Cl)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 C12H13Cl3N2O4S MW 387.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13Cl3N2O4S/c1-5-6(10(19)21-4)8(16-11(20)12(13,14)15)22-7(5)9(18)17(2)3/h1-4H3,(H,16,20)
InChIKey
XIHBFNSFWOGVHV-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)C(Cl)(Cl)Cl)C(=O)N(C)C
InChI=1SC12H13Cl3N2O4Sc156(10(19)214)8(1611(20)12(1314)15)227(5)9(18)17(2)3h14H3(H1620)
METHYL5(DIMETHYLCARBAMOYL)4METHYL2((222TRICHLOROACETYL)AMINO)THIOPHENE3CARBOXYLATE
methyl5(dimethylcarbamoyl)4methyl2((trichloroacetyl)amino)thiophene3carboxylate
METHYL5(NNDIMETHYLCARBAMOYL)4METHYL2(222TRICHLOROACETYLAMINO)THIOPHENE3CARBOXYLATE
MFCD03389893
ZINC000001140250
ZINC01140250
ZINC1140250

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Available files

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