Vitas-M small molecule compound

N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]octanamide

Catalog ID
STK420005
SMILES CCCCCCCC(=O)Nc1sc(c(c1C#N)c1ccc(cc1)CC)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 C22H28N2OS MW 368.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2OS/c1-4-6-7-8-9-10-20(25)24-22-19(15-23)21(16(3)26-22)18-13-11-17(5-2)12-14-18/h11-14H,4-10H2,1-3H3,(H,24,25)
InChIKey
RHAUFPJDNVNIKU-UHFFFAOYSA-N
Synonyms

CCCCCCCC(=O)NC1=C(C(=C(S1)C)C2=CC=C(C=C2)CC)C#N
InChI=1SC22H28N2OSc1467891020(25)242219(1523)21(16(3)2622)18131117(52)121418h1114H410H213H3(H2425)
MFCD03759443
N(3CYANO4(4ETHYLPHENYL)5METHYL2THIENYL)OCTANAMIDE
N(3cyano4(4ethylphenyl)5methylthiophen2yl)octanamide
ZINC000097941900
ZINC97941900

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Available files

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