Vitas-M small molecule compound

methyl 2-[(4-chlorophenyl)amino]-4-oxo-4,5-dihydrothiophene-3-carboxylate

Catalog ID
STK263650
SMILES COC(=O)C1=C(SCC1=O)Nc1ccc(cc1)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 C12H10ClNO3S MW 283.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10ClNO3S/c1-17-12(16)10-9(15)6-18-11(10)14-8-4-2-7(13)3-5-8/h2-5,14H,6H2,1H3
InChIKey
YLNHZDYSLDBNHH-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(SCC1=O)NC2=CC=C(C=C2)Cl
InChI=1SC12H10ClNO3Sc11712(16)109(15)61811(10)148427(13)358h2514H6H21H3
methyl2((4chlorophenyl)amino)4oxo45dihydrothiophene3carboxylate
METHYL2((4CHLOROPHENYL)AMINO)4OXO5HYDROTHIOPHENE3CARBOXYLATE
METHYL2(4CHLOROANILINO)4OXOTHIOPHENE3CARBOXYLATE
MFCD03139787
ZINC000000459185
ZINC00459185
ZINC459185

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Available files

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