Vitas-M small molecule compound
3-{1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-2-thioxo-1,2-dihydropyrido[2,3-d]pyrimidin-7-yl}-4-hydroxy-6-methyl-2H-pyran-2-one
Catalog ID
STL510327
SMILES COc1ccc(cc1OC)CCn1c(=S)nc(c2c1nc(cc2)c1c(O)cc(oc1=O)C)O
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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 C23H21N3O6S MW 467.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O6S/c1-12-10-16(27)19(22(29)32-12)15-6-5-14-20(24-15)26(23(33)25-21(14)28)9-8-13-4-7-17(30-2)18(11-13)31-3/h4-7,10-11,27H,8-9H2,1-3H3,(H,25,28,33)InChIKey
GHZGTXHXMMOYBM-UHFFFAOYSA-NSynonyms
1(2(34dimethoxyphenyl)ethyl)7(4hydroxy6methyl2oxopyran3yl)2sulfanylidenepyrido(23d)pyrimidin4one
135638381
3(1(2(34dimethoxyphenyl)ethyl)4hydroxy2thioxo12dihydropyrido(23d)pyrimidin7yl)4hydroxy6methyl2Hpyran2one
InChI=1SC23H21N3O6Sc1121016(27)19(22(29)3212)15651420(2415)26(23(33)2521(14)28)98134717(302)18(1113)313h47101127H89H213H3(H252833)
MFCD31711418
ZINC001547208832
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