Vitas-M small molecule compound
N-(4-fluorophenyl)-2-[3-(4-methylbenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Catalog ID
STK879217
SMILES Cc1ccc(cc1)Cn1nnc2c1ncn(c2=O)CC(=O)Nc1ccc(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 C20H17FN6O2 MW 392.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17FN6O2/c1-13-2-4-14(5-3-13)10-27-19-18(24-25-27)20(29)26(12-22-19)11-17(28)23-16-8-6-15(21)7-9-16/h2-9,12H,10-11H2,1H3,(H,23,28)InChIKey
YOOUHEISKMNJIE-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)CN2C3=C(C(=O)N(C=N3)CC(=O)NC4=CC=C(C=C4)F)N=N2
InChI=1SC20H17FN6O2c1132414(5313)10271918(242527)20(29)26(122219)1117(28)23168615(21)7916h2912H1011H21H3(H2328)
MFCD05713012
N(4fluorophenyl)2(3((4methylphenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)acetamide
N(4fluorophenyl)2(3(4methylbenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)acetamide
ZINC000005031664
ZINC05031664
ZINC5031664
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