Vitas-M small molecule compound

N-(3-chlorobenzyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Catalog ID
STL028201
SMILES Clc1cccc(c1)CNC(=O)c1cc2c(s1)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 C16H16ClNOS MW 305.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClNOS/c17-13-6-3-4-11(8-13)10-18-16(19)15-9-12-5-1-2-7-14(12)20-15/h3-4,6,8-9H,1-2,5,7,10H2,(H,18,19)
InChIKey
NMQBDCXCHFAACR-UHFFFAOYSA-N
Synonyms
895699-91-9
895699919
C1CCC2=C(C1)C=C(S2)C(=O)NCC3=CC(=CC=C3)Cl
InChI=1SC16H16ClNOSc171363411(813)101816(19)15912512714(12)2015h34689H125710H2(H1819)
MFCD04806925
N((3chlorophenyl)methyl)4567tetrahydro1benzothiophene2carboxamide
N(3chlorobenzyl)4567tetrahydro1benzothiophene2carboxamide
ZINC000005679183
ZINC05679183
ZINC5679183

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Available files

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