Vitas-M small molecule compound

ethyl {[3-cyano-4-(cyclohex-3-en-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl]sulfanyl}acetate

Catalog ID
STL115871
SMILES CCOC(=O)CSc1nc2CCCc2c(c1C#N)C1CCC=CC1

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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 C19H22N2O2S MW 342.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O2S/c1-2-23-17(22)12-24-19-15(11-20)18(13-7-4-3-5-8-13)14-9-6-10-16(14)21-19/h3-4,13H,2,5-10,12H2,1H3
InChIKey
QDQHNCRJHYQKCD-UHFFFAOYSA-N
Synonyms
337500-97-7
337500977
CCOC(=O)CSC1=NC2=C(CCC2)C(=C1C#N)C3CCC=CC3
ethyl((3cyano4(cyclohex3en1yl)67dihydro5Hcyclopenta(b)pyridin2yl)sulfanyl)acetate
ETHYL2((3CYANO4(CYCLOHEX3EN1YL)67DIHYDRO5HCYCLOPENTA(B)PYRIDIN2YL)THIO)ACETATE
ETHYL2((3CYANO4CYCLOHEX3EN1YL67DIHYDRO5HCYCLOPENTA(B)PYRIDIN2YL)SULFANYL)ACETATE
ETHYL2(3CYANO4CYCLOHEX3ENYL567TRIHYDROCYCLOPENTA(21E)PYRIDIN2YLTHIO)ACETATE
InChI=1SC19H22N2O2Sc122317(22)12241915(1120)18(137435813)14961016(14)2119h3413H251012H21H3
MFCD02047834
ZINC000000128863
ZINC000000128867

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Available files

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