Vitas-M small molecule compound
N-(3-fluorophenyl)-2-[3-(2-methylbenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Catalog ID
STK879118
SMILES Fc1cccc(c1)NC(=O)Cn1cnc2c(c1=O)nnn2Cc1ccccc1C
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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/c1-13-5-2-3-6-14(13)10-27-19-18(24-25-27)20(29)26(12-22-19)11-17(28)23-16-8-4-7-15(21)9-16/h2-9,12H,10-11H2,1H3,(H,23,28)InChIKey
NWHKZSLRKFJNCJ-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1CN2C3=C(C(=O)N(C=N3)CC(=O)NC4=CC(=CC=C4)F)N=N2
InChI=1SC20H17FN6O2c113523614(13)10271918(242527)20(29)26(122219)1117(28)231684715(21)916h2912H1011H21H3(H2328)
MFCD18170527
N(3fluorophenyl)2(3((2methylphenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)acetamide
N(3fluorophenyl)2(3(2methylbenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)acetamide
ZINC000040477218
ZINC40477218
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