Vitas-M small molecule compound
N-(4-fluorophenyl)-2-{7-oxo-3-[3-(trifluoromethyl)benzyl]-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetamide
Catalog ID
STK879045
SMILES Fc1ccc(cc1)NC(=O)Cn1cnc2c(c1=O)nnn2Cc1cccc(c1)C(F)(F)F
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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 C20H14F4N6O2 MW 446.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14F4N6O2/c21-14-4-6-15(7-5-14)26-16(31)10-29-11-25-18-17(19(29)32)27-28-30(18)9-12-2-1-3-13(8-12)20(22,23)24/h1-8,11H,9-10H2,(H,26,31)InChIKey
DIWUOJPSKIREJB-UHFFFAOYSA-NSynonyms
C1=CC(=CC(=C1)C(F)(F)F)CN2C3=C(C(=O)N(C=N3)CC(=O)NC4=CC=C(C=C4)F)N=N2
InChI=1SC20H14F4N6O2c21144615(7514)2616(31)102911251817(19(29)32)272830(18)91221313(812)20(2223)24h1811H910H2(H2631)
MFCD18170454
N(4fluorophenyl)2(7oxo3((3(trifluoromethyl)phenyl)methyl)triazolo(45d)pyrimidin6yl)acetamide
N(4fluorophenyl)2(7oxo3(3(trifluoromethyl)benzyl)37dihydro6H(123)triazolo(45d)pyrimidin6yl)acetamide
ZINC000040477145
ZINC40477145
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