Vitas-M small molecule compound
N-(4-acetylphenyl)-2-[3-(4-methylbenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Catalog ID
STK879238
SMILES O=C(Cn1cnc2c(c1=O)nnn2Cc1ccc(cc1)C)Nc1ccc(cc1)C(=O)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 C22H20N6O3 MW 416.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N6O3/c1-14-3-5-16(6-4-14)11-28-21-20(25-26-28)22(31)27(13-23-21)12-19(30)24-18-9-7-17(8-10-18)15(2)29/h3-10,13H,11-12H2,1-2H3,(H,24,30)InChIKey
NIWXYMCQLKCIPR-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)CN2C3=C(C(=O)N(C=N3)CC(=O)NC4=CC=C(C=C4)C(=O)C)N=N2
InChI=1SC22H20N6O3c1143516(6414)11282120(252628)22(31)27(132321)1219(30)24189717(81018)15(2)29h31013H1112H212H3(H2430)
MFCD05713031
N(4acetylphenyl)2(3((4methylphenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)acetamide
N(4acetylphenyl)2(3(4methylbenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)acetamide
ZINC000005031732
ZINC05031732
ZINC5031732
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