Vitas-M small molecule compound

dimethyl 5-{[(3-chlorophenyl)carbonyl]amino}-3-methylthiophene-2,4-dicarboxylate

Catalog ID
STK435346
SMILES COC(=O)c1c(NC(=O)c2cccc(c2)Cl)sc(c1C)C(=O)OC

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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 C16H14ClNO5S MW 367.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClNO5S/c1-8-11(15(20)22-2)14(24-12(8)16(21)23-3)18-13(19)9-5-4-6-10(17)7-9/h4-7H,1-3H3,(H,18,19)
InChIKey
YUKBWFXJSCJMRD-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC(=CC=C2)Cl)C(=O)OC
dimethyl5(((3chlorophenyl)carbonyl)amino)3methylthiophene24dicarboxylate
DIMETHYL5((3CHLOROBENZOYL)AMINO)3METHYLTHIOPHENE24DICARBOXYLATE
DIMETHYL5(3CHLOROBENZAMIDO)3METHYLTHIOPHENE24DICARBOXYLATE
InChI=1SC16H14ClNO5Sc1811(15(20)222)14(2412(8)16(21)233)1813(19)954610(17)79h47H13H3(H1819)
METHYL2((3CHLOROPHENYL)CARBONYLAMINO)5(METHOXYCARBONYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD03365540
ZINC000000669131
ZINC00669131
ZINC669131

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Available files

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