Vitas-M small molecule compound
ethyl 4-{[4-cyano-1-(morpholin-4-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}butanoate
Catalog ID
STK608374
SMILES CCOC(=O)CCCSc1nc(N2CCOCC2)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 C20H27N3O3S MW 389.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O3S/c1-2-26-18(24)8-5-13-27-20-17(14-21)15-6-3-4-7-16(15)19(22-20)23-9-11-25-12-10-23/h2-13H2,1H3InChIKey
VWLKSSFIFUWXGK-UHFFFAOYSA-NSynonyms
904005-76-1904005761
CCOC(=O)CCCSC1=NC(=C2CCCCC2=C1C#N)N3CCOCC3
ethyl4((4cyano1(morpholin4yl)5678tetrahydroisoquinolin3yl)sulfanyl)butanoate
ethyl4((4cyano1morpholin4yl5678tetrahydroisoquinolin3yl)sulfanyl)butanoate
ethyl4((4cyano1morpholino5678tetrahydroisoquinolin3yl)thio)butanoate
InChI=1SC20H27N3O3Sc122618(24)8513272017(1421)15634716(15)19(2220)2391125121023h213H21H3
MFCD08288414
ZINC000020573746
ZINC20573746
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