Vitas-M small molecule compound
3-ethyl-6-hydroxy-2-(octylsulfanyl)-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4(3H)-one
Catalog ID
STK549209
SMILES CCCCCCCCSc1nc(O)c(c(=O)n1CC)C1NCCc2c1cccc2
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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 C23H33N3O2S MW 415.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H33N3O2S/c1-3-5-6-7-8-11-16-29-23-25-21(27)19(22(28)26(23)4-2)20-18-13-10-9-12-17(18)14-15-24-20/h9-10,12-13,20,24,27H,3-8,11,14-16H2,1-2H3InChIKey
WJXMCCJTYPXIIB-UHFFFAOYSA-NSynonyms
836645-08-03ethyl6hydroxy2(octylsulfanyl)5(1234tetrahydroisoquinolin1yl)pyrimidin4(3H)one
3ethyl6hydroxy2(octylthio)5(1234tetrahydroisoquinolin1yl)pyrimidin4(3H)one
836645080
MFCD03691430
ZINC000097952454
ZINC000097952455
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