Vitas-M small molecule compound
N-(4-acetylphenyl)-2-{7-oxo-3-[3-(trifluoromethyl)benzyl]-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetamide
Catalog ID
STK879064
SMILES O=C(Cn1cnc2c(c1=O)nnn2Cc1cccc(c1)C(F)(F)F)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 C22H17F3N6O3 MW 470.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F3N6O3/c1-13(32)15-5-7-17(8-6-15)27-18(33)11-30-12-26-20-19(21(30)34)28-29-31(20)10-14-3-2-4-16(9-14)22(23,24)25/h2-9,12H,10-11H2,1H3,(H,27,33)InChIKey
GSDKMQDDUPQNEU-UHFFFAOYSA-NSynonyms
CC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)N=NN3CC4=CC(=CC=C4)C(F)(F)F
InChI=1SC22H17F3N6O3c113(32)155717(8615)2718(33)113012262019(21(30)34)282931(20)101432416(914)22(2324)25h2912H1011H21H3(H2733)
MFCD18170473
N(4acetylphenyl)2(7oxo3((3(trifluoromethyl)phenyl)methyl)triazolo(45d)pyrimidin6yl)acetamide
N(4acetylphenyl)2(7oxo3(3(trifluoromethyl)benzyl)37dihydro6H(123)triazolo(45d)pyrimidin6yl)acetamide
ZINC000040477164
ZINC40477164
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