Vitas-M small molecule compound
2,7,7-trimethyl-1-(1-phenylethyl)-4,4-bis(trifluoromethyl)-4,6,7,8-tetrahydroquinazolin-5(1H)-one
Catalog ID
STL344138
SMILES CC1=NC(C2=C(N1C(c1ccccc1)C)CC(CC2=O)(C)C)(C(F)(F)F)C(F)(F)F
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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 C21H22F6N2O MW 432.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F6N2O/c1-12(14-8-6-5-7-9-14)29-13(2)28-19(20(22,23)24,21(25,26)27)17-15(29)10-18(3,4)11-16(17)30/h5-9,12H,10-11H2,1-4H3InChIKey
PKQMGLPIULAKDM-UHFFFAOYSA-NSynonyms
846062-05-3277trimethyl1(1phenylethyl)44bis(trifluoromethyl)4678tetrahydroquinazolin5(1H)one
277TRIMETHYL1(1PHENYLETHYL)44BIS(TRIFLUOROMETHYL)68DIHYDROQUINAZOLIN5ONE
846062053
CC1=NC(C2=C(N1C(C)C3=CC=CC=C3)CC(CC2=O)(C)C)(C(F)(F)F)C(F)(F)F
InChI=1SC21H22F6N2Oc112(148657914)2913(2)2819(20(2223)2421(2526)27)1715(29)1018(34)1116(17)30h5912H1011H214H3
MFCD04173528
ZINC000020392403
ZINC000020392407
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