Vitas-M small molecule compound
3-(4-fluorophenyl)-2-methyl-7-(2-methylcyclohexyl)pyrazolo[5,1-c]pyrido[4,3-e][1,2,4]triazin-6(7H)-one
Catalog ID
STL121752
SMILES Fc1ccc(cc1)c1c(C)nn2c1nnc1c2ccn(c1=O)C1CCCCC1C
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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 C22H22FN5O MW 391.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22FN5O/c1-13-5-3-4-6-17(13)27-12-11-18-20(22(27)29)24-25-21-19(14(2)26-28(18)21)15-7-9-16(23)10-8-15/h7-13,17H,3-6H2,1-2H3InChIKey
LOVJNQQAGKIXJN-UHFFFAOYSA-NSynonyms
3(4fluorophenyl)2methyl7(2methylcyclohexyl)pyrazolo(51c)pyrido(43e)(124)triazin6(7H)one
CC1CCCCC1N2C=CC3=C(C2=O)N=NC4=C(C(=NN34)C)C5=CC=C(C=C5)F
InChI=1SC22H22FN5Oc113534617(13)2712111820(22(27)29)24252119(14(2)2628(18)21)157916(23)10815h71317H36H212H3
MFCD15200410
ZINC000040391916
ZINC000040391923
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