Vitas-M small molecule compound

3-chloro-N-[3-(methylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-benzothiophene-2-carboxamide

Catalog ID
STK705845
SMILES CNC(=O)c1c(sc2c1CCCC2)NC(=O)c1sc2c(c1Cl)cccc2

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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 C19H17ClN2O2S2 MW 404.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClN2O2S2/c1-21-17(23)14-10-6-2-4-8-12(10)26-19(14)22-18(24)16-15(20)11-7-3-5-9-13(11)25-16/h3,5,7,9H,2,4,6,8H2,1H3,(H,21,23)(H,22,24)
InChIKey
TUFMBJWQYDJHAC-UHFFFAOYSA-N
Synonyms

3chloroN(3(methylcarbamoyl)4567tetrahydro1benzothiophen2yl)1benzothiophene2carboxamide
CNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl
InChI=1SC19H17ClN2O2S2c12117(23)1410624812(10)2619(14)2218(24)1615(20)11735913(11)2516h3579H2468H21H3(H2123)(H2224)
MFCD04214746
ZINC000001131493
ZINC01131493
ZINC1131493

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Available files

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