Vitas-M small molecule compound
6-hydroxy-3-[4-(propan-2-yl)phenyl]-2-sulfanyl-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4(3H)-one
Catalog ID
STL037841
SMILES Oc1nc(S)n(c(=O)c1C1NCCc2c1cccc2)c1ccc(cc1)C(C)C
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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 C22H23N3O2S MW 393.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O2S/c1-13(2)14-7-9-16(10-8-14)25-21(27)18(20(26)24-22(25)28)19-17-6-4-3-5-15(17)11-12-23-19/h3-10,13,19,23,26H,11-12H2,1-2H3,(H,24,28)InChIKey
CAQLXFCGKVKQHU-UHFFFAOYSA-NSynonyms
6hydroxy3(4(propan2yl)phenyl)2sulfanyl5(1234tetrahydroisoquinolin1yl)pyrimidin4(3H)one
MFCD04082459
ZINC000017197985
ZINC000017197988
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