Vitas-M small molecule compound
N-(2-fluorophenyl)-2-[3-(3-methoxybenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Catalog ID
STK879347
SMILES COc1cccc(c1)Cn1nnc2c1ncn(c2=O)CC(=O)Nc1ccccc1F
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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 C20H17FN6O3 MW 408.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17FN6O3/c1-30-14-6-4-5-13(9-14)10-27-19-18(24-25-27)20(29)26(12-22-19)11-17(28)23-16-8-3-2-7-15(16)21/h2-9,12H,10-11H2,1H3,(H,23,28)InChIKey
BJIYKNRQQKKONF-UHFFFAOYSA-NSynonyms
COC1=CC=CC(=C1)CN2C3=C(C(=O)N(C=N3)CC(=O)NC4=CC=CC=C4F)N=N2
InChI=1SC20H17FN6O3c1301464513(914)10271918(242527)20(29)26(122219)1117(28)2316832715(16)21h2912H1011H21H3(H2328)
MFCD18170694
N(2fluorophenyl)2(3((3methoxyphenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)acetamide
N(2fluorophenyl)2(3(3methoxybenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)acetamide
ZINC000040478139
ZINC40478139
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