Vitas-M small molecule compound
N-(2,3-dimethylphenyl)-2-{7-oxo-3-[3-(trifluoromethyl)benzyl]-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetamide
Catalog ID
STK879069
SMILES O=C(Cn1cnc2c(c1=O)nnn2Cc1cccc(c1)C(F)(F)F)Nc1cccc(c1C)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 C22H19F3N6O2 MW 456.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19F3N6O2/c1-13-5-3-8-17(14(13)2)27-18(32)11-30-12-26-20-19(21(30)33)28-29-31(20)10-15-6-4-7-16(9-15)22(23,24)25/h3-9,12H,10-11H2,1-2H3,(H,27,32)InChIKey
DGIXOPZXVFPKOI-UHFFFAOYSA-NSynonyms
CC1=C(C(=CC=C1)NC(=O)CN2C=NC3=C(C2=O)N=NN3CC4=CC(=CC=C4)C(F)(F)F)C
InChI=1SC22H19F3N6O2c11353817(14(13)2)2718(32)113012262019(21(30)33)282931(20)101564716(915)22(2324)25h3912H1011H212H3(H2732)
MFCD18170478
N(23dimethylphenyl)2(7oxo3((3(trifluoromethyl)phenyl)methyl)triazolo(45d)pyrimidin6yl)acetamide
N(23dimethylphenyl)2(7oxo3(3(trifluoromethyl)benzyl)37dihydro6H(123)triazolo(45d)pyrimidin6yl)acetamide
ZINC000040477169
ZINC40477169
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