Vitas-M small molecule compound
2-{[7,7-dimethyl-2-(4-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Catalog ID
STK589666
SMILES O=C(Nc1cccc(c1)C)CSc1nc(nc2c1COC(C2)(C)C)c1ccc(cc1)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 C25H27N3O2S MW 433.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O2S/c1-16-8-10-18(11-9-16)23-27-21-13-25(3,4)30-14-20(21)24(28-23)31-15-22(29)26-19-7-5-6-17(2)12-19/h5-12H,13-15H2,1-4H3,(H,26,29)InChIKey
MXMHDFNMCMCPDE-UHFFFAOYSA-NSynonyms
900896-54-02((77DIMETHYL2(4METHYLPHENYL)58DIHYDROPYRANO(43D)PYRIMIDIN4YL)SULFANYL)N(3METHYLPHENYL)ACETAMIDE
2((77dimethyl2(4methylphenyl)78dihydro5Hpyrano(43d)pyrimidin4yl)sulfanyl)N(3methylphenyl)acetamide
2((77dimethyl2(ptolyl)78dihydro5Hpyrano(43d)pyrimidin4yl)thio)N(mtolyl)acetamide
900896540
CC1=CC=C(C=C1)C2=NC3=C(COC(C3)(C)C)C(=N2)SCC(=O)NC4=CC=CC(=C4)C
InChI=1SC25H27N3O2Sc11681018(11916)2327211325(34)301420(21)24(2823)311522(29)261975617(2)1219h512H1315H214H3(H2629)
MFCD06776255
ZINC000013555813
ZINC13555813
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