Vitas-M small molecule compound
(2E)-2-(4-hydroxyquinazolin-2-yl)-3-{1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}prop-2-enenitrile
Catalog ID
STK608284
SMILES CCCSc1ccc(cc1)c1nn(cc1/C=C(/c1nc(O)c2c(n1)cccc2)\C#N)c1ccccc1
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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 C29H23N5OS MW 489.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N5OS/c1-2-16-36-24-14-12-20(13-15-24)27-22(19-34(33-27)23-8-4-3-5-9-23)17-21(18-30)28-31-26-11-7-6-10-25(26)29(35)32-28/h3-15,17,19H,2,16H2,1H3,(H,31,32,35)/b21-17+InChIKey
PMAJQYYDANNPTQ-HEHNFIMWSA-NSynonyms
956760-04-6(2E)2(4hydroxyquinazolin2yl)3(1phenyl3(4(propylsulfanyl)phenyl)1Hpyrazol4yl)prop2enenitrile
(E)2(4OXO1HQUINAZOLIN2YL)3(1PHENYL3(4PROPYLSULFANYLPHENYL)PYRAZOL4YL)PROP2ENENITRILE
956760046
CCCSc1ccc(cc1)c1nn(cc1C=C(c1nc(O)c2c(n1)cccc2)C#N)c1ccccc1
InChI=1SC29H23N5OSc12163624141220(131524)2722(1934(3327)238435923)1721(1830)28312611761025(26)29(35)3228h3151719H216H21H3(H313235)b2117+
MFCD08733411
ZINC000009461361
ZINC9461361
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