Vitas-M small molecule compound
N-(4-fluorobenzyl)-2-[7-(4-methoxyphenyl)-5-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Catalog ID
STL093144
SMILES COc1ccc(cc1)c1cc2nn(c(=O)n2c(n1)C)CC(=O)NCc1ccc(cc1)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 C22H20FN5O3 MW 421.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20FN5O3/c1-14-25-19(16-5-9-18(31-2)10-6-16)11-20-26-27(22(30)28(14)20)13-21(29)24-12-15-3-7-17(23)8-4-15/h3-11H,12-13H2,1-2H3,(H,24,29)InChIKey
XJSVHOMVGOIJCD-UHFFFAOYSA-NSynonyms
CC1=NC(=CC2=NN(C(=O)N12)CC(=O)NCC3=CC=C(C=C3)F)C4=CC=C(C=C4)OC
InChI=1SC22H20FN5O3c1142519(165918(312)10616)11202627(22(30)28(14)20)1321(29)2412153717(23)8415h311H1213H212H3(H2429)
MFCD18787278
N((4fluorophenyl)methyl)2(7(4methoxyphenyl)5methyl3oxo(124)triazolo(43c)pyrimidin2yl)acetamide
N(4fluorobenzyl)2(7(4methoxyphenyl)5methyl3oxo(124)triazolo(43c)pyrimidin2(3H)yl)acetamide
ZINC000065196717
ZINC65196717
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