Vitas-M small molecule compound

N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide

Catalog ID
STK805012
SMILES N#Cc1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1ccccc1

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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 C20H22N2OS MW 338.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2OS/c1-20(2,3)14-9-10-15-16(12-21)19(24-17(15)11-14)22-18(23)13-7-5-4-6-8-13/h4-8,14H,9-11H2,1-3H3,(H,22,23)
InChIKey
WQYFYKIQHJQKML-UHFFFAOYSA-N
Synonyms
351008-62-3
351008623
CC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC=CC=C3
InChI=1SC20H22N2OSc120(23)149101516(1221)19(2417(15)1114)2218(23)137546813h4814H911H213H3(H2223)
MFCD01855510
N(6(tertbutyl)3cyano4567tetrahydrobenzo(b)thiophen2yl)benzamide
N(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)benzamide
ZINC000000209983
ZINC000000209985

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Available files

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