Vitas-M small molecule compound

ethyl 2-{[(3-chloro-6-methyl-1-benzothiophen-2-yl)carbonyl]amino}-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate

Catalog ID
STK432441
SMILES CCOC(=O)c1c(NC(=O)c2sc3c(c2Cl)ccc(c3)C)sc(c1C)C(=O)N(CC)CC

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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 C23H25ClN2O4S2 MW 493.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25ClN2O4S2/c1-6-26(7-2)22(28)18-13(5)16(23(29)30-8-3)21(32-18)25-20(27)19-17(24)14-10-9-12(4)11-15(14)31-19/h9-11H,6-8H2,1-5H3,(H,25,27)
InChIKey
OKBRHXYEBFONKU-UHFFFAOYSA-N
Synonyms

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)C)Cl)C(=O)OCC)C
ETHYL2(((3CHLORO6METHYL1BENZOTHIEN2YL)CARBONYL)AMINO)5((DIETHYLAMINO)CARBONYL)4METHYL3THIOPHENECARBOXYLATE
ethyl2(((3chloro6methyl1benzothiophen2yl)carbonyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
ETHYL2((3CHLORO6METHYL1BENZOTHIOPHENE2CARBONYL)AMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5(NNDIETHYLCARBAMOYL)2((3CHLORO6METHYLBENZO(B)THIOPHEN2YL)CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC23H25ClN2O4S2c1626(72)22(28)1813(5)16(23(29)3083)21(3218)2520(27)1917(24)1410912(4)1115(14)3119h911H68H215H3(H2527)
MFCD03377138
ZINC000000656026
ZINC00656026
ZINC656026

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Available files

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