[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoate

Systemtic Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoate Openeye Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3-(3-oxo-4H-quinoxalin-2-yl)propanoate CAS Name: 3-(3-oxo-4H-quinoxalin-2-yl)propanoic acid [4-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl] 3-(3-oxo-4H-quinoxalin-2-yl)propanoate Traditional Name: 3-(3-keto-4H-quinoxalin-2-yl)propionic acid [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ester Formula: C28H23N5O3 MolecularWeight: 477.51392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)CCC3=NC4=CC=CC=C4NC3=O)C5=CC=CC=C5

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)CCC3=NC4=CC=CC=C4NC3=O)C5=CC=CC=C5

InChI

InChI=1S/C28H23N5O3/c1-18-29-25(19-7-3-2-4-8-19)17-26(30-18)31-20-11-13-21(14-12-20)36-27(34)16-15-24-28(35)33-23-10-6-5-9-22(23)32-24/h2-14,17H,15-16H2,1H3,(H,33,35)(H,29,30,31)