Vitas-M small molecule compound
tert-butyl [(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]acetate
Catalog ID
STL329962
SMILES N#Cc1c(SCC(=O)OC(C)(C)C)nc2c(c1c1ccccc1)CCC2
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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 C21H22N2O2S MW 366.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O2S/c1-21(2,3)25-18(24)13-26-20-16(12-22)19(14-8-5-4-6-9-14)15-10-7-11-17(15)23-20/h4-6,8-9H,7,10-11,13H2,1-3H3InChIKey
VRXCVGBODDWFER-UHFFFAOYSA-NSynonyms
CC(C)(C)OC(=O)CSC1=NC2=C(CCC2)C(=C1C#N)C3=CC=CC=C3
InChI=1SC21H22N2O2Sc121(23)2518(24)13262016(1222)19(148546914)151071117(15)2320h4689H7101113H213H3
MFCD00855251
tertbutyl((3cyano4phenyl67dihydro5Hcyclopenta(b)pyridin2yl)sulfanyl)acetate
TERTBUTYL2((3CYANO4PHENYL67DIHYDRO5HCYCLOPENTA(B)PYRIDIN2YL)SULFANYL)ACETATE
tertbutyl2((3cyano4phenyl67dihydro5Hcyclopenta(b)pyridin2yl)thio)acetate
ZINC000002248806
ZINC02248806
ZINC2248806
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