3-azanyl-5-[6-[2-(2-methoxyethylamino)-6-(trifluoromethyl)pyridin-3-yl]pyrimidin-4-yl]oxy-1H-quinoxalin-2-one

Systemtic Name: 3-azanyl-5-[6-[2-(2-methoxyethylamino)-6-(trifluoromethyl)pyridin-3-yl]pyrimidin-4-yl]oxy-1H-quinoxalin-2-one Openeye Name: 3-amino-5-[6-[2-(2-methoxyethylamino)-6-(trifluoromethyl)-3-pyridyl]pyrimidin-4-yl]oxy-1H-quinoxalin-2-one CAS Name: 3-amino-5-[[6-[2-(2-methoxyethylamino)-6-(trifluoromethyl)-3-pyridinyl]-4-pyrimidinyl]oxy]-1H-quinoxalin-2-one IUPAC Name: 3-amino-5-[6-[2-(2-methoxyethylamino)-6-(trifluoromethyl)pyridin-3-yl]pyrimidin-4-yl]oxy-1H-quinoxalin-2-one Traditional Name: 3-amino-5-[6-[2-(2-methoxyethylamino)-6-(trifluoromethyl)-3-pyridyl]pyrimidin-4-yl]oxy-1H-quinoxalin-2-one Formula: C21H18F3N7O3 MolecularWeight: 473.40793

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=CC(=N1)C(F)(F)F)C2=CC(=NC=N2)OC3=CC=CC4=C3N=C(C(=O)N4)N

Isomeric SMILES

COCCNC1=C(C=CC(=N1)C(F)(F)F)C2=CC(=NC=N2)OC3=CC=CC4=C3N=C(C(=O)N4)N

InChI

InChI=1S/C21H18F3N7O3/c1-33-8-7-26-19-11(5-6-15(30-19)21(22,23)24)13-9-16(28-10-27-13)34-14-4-2-3-12-17(14)31-18(25)20(32)29-12/h2-6,9-10H,7-8H2,1H3,(H2,25,31)(H,26,30)(H,29,32)