Vitas-M small molecule compound
7-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-1-(2-methoxyphenyl)-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STL396580
SMILES COc1ccccc1n1c(S)nc(=O)c2c1nc(cc2C(F)(F)F)c1cn(nc1C)CC
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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 C21H18F3N5O2S MW 461.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F3N5O2S/c1-4-28-10-12(11(2)27-28)14-9-13(21(22,23)24)17-18(25-14)29(20(32)26-19(17)30)15-7-5-6-8-16(15)31-3/h5-10H,4H2,1-3H3,(H,26,30,32)InChIKey
DBNOVCWYAHJTDI-UHFFFAOYSA-NSynonyms
1174886-21-51174886215
7(1ETHYL3METHYL1HPYRAZOL4YL)1(2METHOXYPHENYL)2SULFANYL5(TRIFLUOROMETHYL)PYRIDO(23D)PYRIMIDIN4(1H)ONE
7(1ethyl3methylpyrazol4yl)1(2methoxyphenyl)2sulfanylidene5(trifluoromethyl)pyrido(23d)pyrimidin4one
CCN1C=C(C(=N1)C)C2=NC3=C(C(=C2)C(F)(F)F)C(=O)NC(=S)N3C4=CC=CC=C4OC
InChI=1SC21H18F3N5O2Sc14281012(11(2)2728)14913(21(2223)24)1718(2514)29(20(32)2619(17)30)15756816(15)313h510H4H213H3(H263032)
MFCD10701335
ZINC000036617098
ZINC36617098
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