Vitas-M small molecule compound

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

Catalog ID
STK768084
SMILES COc1c(C)cc(cc1C)NC(=O)c1scc2c1CCCC2

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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 C18H21NO2S MW 315.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO2S/c1-11-8-14(9-12(2)16(11)21-3)19-18(20)17-15-7-5-4-6-13(15)10-22-17/h8-10H,4-7H2,1-3H3,(H,19,20)
InChIKey
CETCZNVPKFZKSW-UHFFFAOYSA-N
Synonyms

CC1=CC(=CC(=C1OC)C)NC(=O)C2=C3CCCCC3=CS2
InChI=1SC18H21NO2Sc111814(912(2)16(11)213)1918(20)1715754613(15)102217h810H47H213H3(H1920)
MFCD03133919
N(4methoxy35dimethylphenyl)4567tetrahydro2benzothiophene1carboxamide
ZINC000000092885
ZINC00092885
ZINC92885

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Available files

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