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

Systemtic Name: 3-azanyl-5-[2-piperazin-1-yl-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]oxy-1H-quinoxalin-2-one Openeye Name: 3-amino-5-[2-piperazin-1-yl-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]oxy-1H-quinoxalin-2-one CAS Name: 3-amino-5-[[2-(1-piperazinyl)-6-[4-(trifluoromethyl)phenyl]-4-pyrimidinyl]oxy]-1H-quinoxalin-2-one IUPAC Name: 3-amino-5-[2-piperazin-1-yl-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]oxy-1H-quinoxalin-2-one Traditional Name: 3-amino-5-[2-piperazino-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]oxy-1H-quinoxalin-2-one Formula: C23H20F3N7O2 MolecularWeight: 483.44581

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC(=CC(=N2)OC3=CC=CC4=C3N=C(C(=O)N4)N)C5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

C1CN(CCN1)C2=NC(=CC(=N2)OC3=CC=CC4=C3N=C(C(=O)N4)N)C5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C23H20F3N7O2/c24-23(25,26)14-6-4-13(5-7-14)16-12-18(31-22(30-16)33-10-8-28-9-11-33)35-17-3-1-2-15-19(17)32-20(27)21(34)29-15/h1-7,12,28H,8-11H2,(H2,27,32)(H,29,34)