Vitas-M small molecule compound
N-(4-methoxyphenyl)-2-[3-(2-methylbenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Catalog ID
STK879091
SMILES COc1ccc(cc1)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 C21H20N6O3 MW 404.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N6O3/c1-14-5-3-4-6-15(14)11-27-20-19(24-25-27)21(29)26(13-22-20)12-18(28)23-16-7-9-17(30-2)10-8-16/h3-10,13H,11-12H2,1-2H3,(H,23,28)InChIKey
KQQXLFIYUVNFLV-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1CN2C3=C(C(=O)N(C=N3)CC(=O)NC4=CC=C(C=C4)OC)N=N2
InChI=1SC21H20N6O3c114534615(14)11272019(242527)21(29)26(132220)1218(28)23167917(302)10816h31013H1112H212H3(H2328)
MFCD18170500
N(4methoxyphenyl)2(3((2methylphenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)acetamide
N(4methoxyphenyl)2(3(2methylbenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)acetamide
ZINC000040477191
ZINC40477191
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