Vitas-M small molecule compound
5-(2-acetyl-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-6-hydroxy-1,3-diphenyl-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Catalog ID
STL527506
SMILES COc1cc2c(cc1OC)CCN(C2c1c(O)n(c2ccccc2)c(=S)n(c1=O)c1ccccc1)C(=O)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 C29H27N3O5S MW 529.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O5S/c1-18(33)30-15-14-19-16-23(36-2)24(37-3)17-22(19)26(30)25-27(34)31(20-10-6-4-7-11-20)29(38)32(28(25)35)21-12-8-5-9-13-21/h4-13,16-17,26,34H,14-15H2,1-3H3InChIKey
PMLKTFBDNKRBHD-UHFFFAOYSA-NSynonyms
1190238-94-81190238948
3625186
5(2acetyl67dimethoxy1234tetrahydroisoquinolin1yl)6hydroxy13diphenyl2thioxo23dihydropyrimidin4(1H)one
5(2acetyl67dimethoxy34dihydro1~(H)isoquinolin1yl)6hydroxy13diphenyl2sulfanylidenepyrimidin4one
5(2ACETYL67DIMETHOXY34DIHYDRO1HISOQUINOLIN1YL)6HYDROXY13DIPHENYL2SULFANYLIDENEPYRIMIDIN4ONE
InChI=1SC29H27N3O5Sc118(33)301514191623(362)24(373)1722(19)26(30)2527(34)31(20106471120)29(38)32(28(25)35)21128591321h41316172634H1415H213H3
MFCD03660354
ZINC000002140291
ZINC000002140294
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