Vitas-M small molecule compound
[5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl](2,6-dimethyloctahydroquinolin-1(2H)-yl)methanone
Catalog ID
STL390881
SMILES COc1ccc(cc1OC)c1nc2cc(nn2c(c1)C(F)(F)F)C(=O)N1C(C)CCC2C1CCC(C2)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 C27H31F3N4O3 MW 516.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31F3N4O3/c1-15-5-9-21-18(11-15)7-6-16(2)33(21)26(35)20-14-25-31-19(13-24(27(28,29)30)34(25)32-20)17-8-10-22(36-3)23(12-17)37-4/h8,10,12-16,18,21H,5-7,9,11H2,1-4H3InChIKey
AHEACCRVCMYRBY-UHFFFAOYSA-NSynonyms
489451-37-8(5(34dimethoxyphenyl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)(26dimethyl344a56788aoctahydro2Hquinolin1yl)methanone
(5(34dimethoxyphenyl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)(26dimethyloctahydroquinolin1(2H)yl)methanone
1((5(34DIMETHOXYPHENYL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDIN2YL)CARBONYL)26DIMETHYLDECAHYDROQUINOLINE
489451378
CC1CCC2C(C1)CCC(N2C(=O)C3=NN4C(=CC(=NC4=C3)C5=CC(=C(C=C5)OC)OC)C(F)(F)F)C
InChI=1SC27H31F3N4O3c115592118(1115)7616(2)33(21)26(35)2014253119(1324(27(2829)30)34(25)3220)1781022(363)23(1217)374h81012161821H57911H214H3
MFCD02056031
ZINC000017130699
ZINC000245238729
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