Vitas-M small molecule compound
N-cyclohexyl-2-{7-methyl-3-oxo-5-[4-(trifluoromethyl)phenyl][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl}acetamide
Catalog ID
STL093074
SMILES O=C(Cn1nc2n(c1=O)c(nc(c2)C)c1ccc(cc1)C(F)(F)F)NC1CCCCC1
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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 C21H22F3N5O2 MW 433.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F3N5O2/c1-13-11-17-27-28(12-18(30)26-16-5-3-2-4-6-16)20(31)29(17)19(25-13)14-7-9-15(10-8-14)21(22,23)24/h7-11,16H,2-6,12H2,1H3,(H,26,30)InChIKey
BHIJCJYVDRPAPU-UHFFFAOYSA-NSynonyms
CC1=CC2=NN(C(=O)N2C(=N1)C3=CC=C(C=C3)C(F)(F)F)CC(=O)NC4CCCCC4
InChI=1SC21H22F3N5O2c11311172728(1218(30)26165324616)20(31)29(17)19(2513)147915(10814)21(2223)24h71116H2612H21H3(H2630)
MFCD18787208
Ncyclohexyl2(7methyl3oxo5(4(trifluoromethyl)phenyl)(124)triazolo(43c)pyrimidin2(3H)yl)acetamide
Ncyclohexyl2(7methyl3oxo5(4(trifluoromethyl)phenyl)(124)triazolo(43c)pyrimidin2yl)acetamide
ZINC000067226409
ZINC67226409
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