3-[2-(1-phenylethylamino)pyrimidin-4-yl]-5H-imidazo[4,5-g]quinazolin-8-one

Systemtic Name: 3-[2-(1-phenylethylamino)pyrimidin-4-yl]-5H-imidazo[4,5-g]quinazolin-8-one Openeye Name: 3-[2-(1-phenylethylamino)pyrimidin-4-yl]-5H-imidazo[4,5-g]quinazolin-8-one CAS Name: 3-[2-(1-phenylethylamino)-4-pyrimidinyl]-5H-imidazo[4,5-g]quinazolin-8-one IUPAC Name: 3-[2-(1-phenylethylamino)pyrimidin-4-yl]-5H-imidazo[4,5-g]quinazolin-8-one Traditional Name: 3-[2-(1-phenylethylamino)pyrimidin-4-yl]-5H-imidazo[4,5-g]quinazolin-8-one Formula: C21H17N7O MolecularWeight: 383.40598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=C5C(=C4)C(=O)N=CN5

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=C5C(=C4)C(=O)N=CN5

InChI

InChI=1S/C21H17N7O/c1-13(14-5-3-2-4-6-14)26-21-22-8-7-19(27-21)28-12-25-17-9-15-16(10-18(17)28)23-11-24-20(15)29/h2-13H,1H3,(H,22,26,27)(H,23,24,29)