Vitas-M small molecule compound
2-[3-(4-chlorobenzyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-(2-ethyl-6-methylphenyl)acetamide
Catalog ID
STK879172
SMILES CCc1cccc(c1NC(=O)Cn1cnc2c(c1=O)nnn2Cc1ccc(cc1)Cl)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 C22H21ClN6O2 MW 436.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN6O2/c1-3-16-6-4-5-14(2)19(16)25-18(30)12-28-13-24-21-20(22(28)31)26-27-29(21)11-15-7-9-17(23)10-8-15/h4-10,13H,3,11-12H2,1-2H3,(H,25,30)InChIKey
CJTFJISOUALTSB-UHFFFAOYSA-NSynonyms
2(3((4chlorophenyl)methyl)7oxotriazolo(45d)pyrimidin6yl)N(2ethyl6methylphenyl)acetamide
2(3(4chlorobenzyl)7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)N(2ethyl6methylphenyl)acetamide
CCC1=CC=CC(=C1NC(=O)CN2C=NC3=C(C2=O)N=NN3CC4=CC=C(C=C4)Cl)C
InChI=1SC22H21ClN6O2c131664514(2)19(16)2518(30)122813242120(22(28)31)262729(21)11157917(23)10815h41013H31112H212H3(H2530)
MFCD18170554
ZINC000040477997
ZINC40477997
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