Vitas-M small molecule compound

N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-phenylpropanamide

Catalog ID
STK062043
SMILES CCC(C1CCc2c(C1)sc(c2C#N)NC(=O)CCc1ccccc1)(C)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 C23H28N2OS MW 380.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2OS/c1-4-23(2,3)17-11-12-18-19(15-24)22(27-20(18)14-17)25-21(26)13-10-16-8-6-5-7-9-16/h5-9,17H,4,10-14H2,1-3H3,(H,25,26)
InChIKey
SVEHVNVCXDKNFH-UHFFFAOYSA-N
Synonyms

CCC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)CCC3=CC=CC=C3
CCC(C1CCc2c(C1)sc(c2C#N)NC(=O)CCc1ccccc1)(C)C
InChI=1SC23H28N2OSc1423(23)1711121819(1524)22(2720(18)1417)2521(26)1310168657916h5917H41014H213H3(H2526)
MFCD03063998
N(3cyano6(2methylbutan2yl)4567tetrahydro1benzothiophen2yl)3phenylpropanamide
STK062043
ZINC000006273012
ZINC000006273022

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Available files

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