Vitas-M small molecule compound
methyl {[4-cyano-1-(piperidin-1-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}acetate
Catalog ID
STK836033
SMILES COC(=O)CSc1nc(N2CCCCC2)c2c(c1C#N)CCCC2
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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 C18H23N3O2S MW 345.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O2S/c1-23-16(22)12-24-18-15(11-19)13-7-3-4-8-14(13)17(20-18)21-9-5-2-6-10-21/h2-10,12H2,1H3InChIKey
GKNOEJHEOCUKOQ-UHFFFAOYSA-NSynonyms
COC(=O)CSC1=NC(=C2CCCCC2=C1C#N)N3CCCCC3
InChI=1SC18H23N3O2Sc12316(22)12241815(1119)13734814(13)17(2018)2195261021h21012H21H3
methyl((4cyano1(piperidin1yl)5678tetrahydroisoquinolin3yl)sulfanyl)acetate
methyl2((4cyano1(piperidin1yl)5678tetrahydroisoquinolin3yl)thio)acetate
methyl2((4cyano1piperidin1yl5678tetrahydroisoquinolin3yl)sulfanyl)acetate
MFCD02070405
ZINC000019799420
ZINC19799420
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