Vitas-M small molecule compound

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

Catalog ID
STK425058
SMILES COC(=O)c1c(NC(=O)c2cccnc2Cl)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 C16H15ClN2O3S MW 350.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN2O3S/c1-22-16(21)12-9-5-2-3-7-11(9)23-15(12)19-14(20)10-6-4-8-18-13(10)17/h4,6,8H,2-3,5,7H2,1H3,(H,19,20)
InChIKey
DFTDCVJTHUVWON-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(N=CC=C3)Cl
InChI=1SC16H15ClN2O3Sc12216(21)129523711(9)2315(12)1914(20)106481813(10)17h468H2357H21H3(H1920)
methyl2(((2chloropyridin3yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2chloropyridine3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD02054369
ZINC000002748685
ZINC02748685
ZINC2748685

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Available files

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