Vitas-M small molecule compound

methyl 2-{[(2-chlorophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK174439
SMILES COC(=O)c1c(NC(=O)c2ccccc2Cl)sc2c1CCCC2

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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 C17H16ClNO3S MW 349.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClNO3S/c1-22-17(21)14-11-7-3-5-9-13(11)23-16(14)19-15(20)10-6-2-4-8-12(10)18/h2,4,6,8H,3,5,7,9H2,1H3,(H,19,20)
InChIKey
FCZUCKOBWXXMLL-UHFFFAOYSA-N
Synonyms
300559-57-3
300559573
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=CC=C3Cl
InChI=1SC17H16ClNO3Sc12217(21)1411735913(11)2316(14)1915(20)10624812(10)18h2468H3579H21H3(H1920)
methyl2(((2chlorophenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2chlorobenzoyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD01243586
ZINC000000035631
ZINC00035631
ZINC35631

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Available files

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