Vitas-M small molecule compound

N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-methylbenzamide

Catalog ID
STK415346
SMILES N#Cc1c(NC(=O)c2cccc(c2)C)sc2c1CCC(C2)C

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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 C18H18N2OS MW 310.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2OS/c1-11-4-3-5-13(8-11)17(21)20-18-15(10-19)14-7-6-12(2)9-16(14)22-18/h3-5,8,12H,6-7,9H2,1-2H3,(H,20,21)
InChIKey
IJIRIWOSMMDIRC-UHFFFAOYSA-N
Synonyms
329222-27-7
329222277
CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=CC=C3)C
InChI=1SC18H18N2OSc11143513(811)17(21)201815(1019)147612(2)916(14)2218h35812H679H212H3(H2021)
MFCD01328119
N(3cyano6methyl4567tetrahydro1benzothiophen2yl)3methylbenzamide
ZINC000000035669
ZINC000002790560

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Available files

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