5-heptyl-6-methyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-4-one

Systemtic Name: 5-heptyl-6-methyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-4-one Openeye Name: 5-heptyl-6-methyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-4-one CAS Name: 5-heptyl-6-methyl-2-[(4,6,7-trimethyl-2-quinazolinyl)amino]-1H-pyrimidin-4-one IUPAC Name: 5-heptyl-6-methyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-4-one Traditional Name: 5-heptyl-6-methyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-1H-pyrimidin-4-one Formula: C23H31N5O MolecularWeight: 393.52514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(NC(=NC1=O)NC2=NC3=CC(=C(C=C3C(=N2)C)C)C)C

Isomeric SMILES

CCCCCCCC1=C(NC(=NC1=O)NC2=NC3=CC(=C(C=C3C(=N2)C)C)C)C

InChI

InChI=1S/C23H31N5O/c1-6-7-8-9-10-11-18-16(4)24-23(27-21(18)29)28-22-25-17(5)19-12-14(2)15(3)13-20(19)26-22/h12-13H,6-11H2,1-5H3,(H2,24,25,26,27,28,29)