Vitas-M small molecule compound

(2E)-2-cyano-N-cycloheptyl-3-(5-ethylthiophen-2-yl)prop-2-enamide

Catalog ID
STK422820
SMILES CCc1ccc(s1)/C=C(/C(=O)NC1CCCCCC1)\C#N

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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 C17H22N2OS MW 302.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2OS/c1-2-15-9-10-16(21-15)11-13(12-18)17(20)19-14-7-5-3-4-6-8-14/h9-11,14H,2-8H2,1H3,(H,19,20)/b13-11+
InChIKey
PPPTUVFPJDJTJX-ACCUITESSA-N
Synonyms

(2E)2CYANONCYCLOHEPTYL3(5ETHYL(2THIENYL))PROP2ENAMIDE
(2E)2cyanoNcycloheptyl3(5ethylthiophen2yl)prop2enamide
(E)2CYANONCYCLOHEPTYL3(5ETHYLTHIOPHEN2YL)PROP2ENAMIDE
CCC1=CC=C(S1)C=C(C#N)C(=O)NC2CCCCCC2
CCc1ccc(s1)C=C(C(=O)NC1CCCCCC1)C#N
InChI=1SC17H22N2OSc121591016(2115)1113(1218)17(20)191475346814h91114H28H21H3(H1920)b1311+
MFCD02176167
ZINC000002758876
ZINC02758876
ZINC2758876

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Available files

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