Vitas-M small molecule compound
N-(2-chloro-6-methylphenyl)-2-[7-(4-methoxyphenyl)-5-methyl-3-oxo[1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Catalog ID
STL093153
SMILES COc1ccc(cc1)c1nc(C)n2c(c1)nn(c2=O)CC(=O)Nc1c(C)cccc1Cl
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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 C22H20ClN5O3 MW 437.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN5O3/c1-13-5-4-6-17(23)21(13)25-20(29)12-27-22(30)28-14(2)24-18(11-19(28)26-27)15-7-9-16(31-3)10-8-15/h4-11H,12H2,1-3H3,(H,25,29)InChIKey
VGFYPWSEFOATGS-UHFFFAOYSA-NSynonyms
CC1=C(C(=CC=C1)Cl)NC(=O)CN2C(=O)N3C(=NC(=CC3=N2)C4=CC=C(C=C4)OC)C
InChI=1SC22H20ClN5O3c11354617(23)21(13)2520(29)122722(30)2814(2)2418(1119(28)2627)157916(313)10815h411H12H213H3(H2529)
MFCD18787287
N(2chloro6methylphenyl)2(7(4methoxyphenyl)5methyl3oxo(124)triazolo(43c)pyrimidin2(3H)yl)acetamide
N(2chloro6methylphenyl)2(7(4methoxyphenyl)5methyl3oxo(124)triazolo(43c)pyrimidin2yl)acetamide
ZINC000067226623
ZINC67226623
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