Vitas-M small molecule compound
2-[3-(3-methoxybenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(3-methylphenyl)acetamide
Catalog ID
STK879338
SMILES COc1cccc(c1)Cn1nnc2c1ncn(c2=O)CC(=O)Nc1cccc(c1)C
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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 C21H20N6O3 MW 404.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O3/c1-14-5-3-7-16(9-14)23-18(28)12-26-13-22-20-19(21(26)29)24-25-27(20)11-15-6-4-8-17(10-15)30-2/h3-10,13H,11-12H2,1-2H3,(H,23,28)InChIKey
JSKCOPBFYBNVIY-UHFFFAOYSA-NSynonyms
2(3((3methoxyphenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)N(3methylphenyl)acetamide
2(3(3methoxybenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)N(3methylphenyl)acetamide
CC1=CC(=CC=C1)NC(=O)CN2C=NC3=C(C2=O)N=NN3CC4=CC(=CC=C4)OC
InChI=1SC21H20N6O3c11453716(914)2318(28)122613222019(21(26)29)242527(20)111564817(1015)302h31013H1112H212H3(H2328)
MFCD18170685
ZINC000040478130
ZINC40478130
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