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

Systemtic Name: 5-heptyl-6-methyl-2-[(4-methylquinazolin-2-yl)amino]-1H-pyrimidin-4-one Openeye Name: 5-heptyl-6-methyl-2-[(4-methylquinazolin-2-yl)amino]-1H-pyrimidin-4-one CAS Name: 5-heptyl-6-methyl-2-[(4-methyl-2-quinazolinyl)amino]-1H-pyrimidin-4-one IUPAC Name: 5-heptyl-6-methyl-2-[(4-methylquinazolin-2-yl)amino]-1H-pyrimidin-4-one Traditional Name: 5-heptyl-6-methyl-2-[(4-methylquinazolin-2-yl)amino]-1H-pyrimidin-4-one Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N5O/c1-4-5-6-7-8-12-17-15(3)23-21(25-19(17)27)26-20-22-14(2)16-11-9-10-13-18(16)24-20/h9-11,13H,4-8,12H2,1-3H3,(H2,22,23,24,25,26,27)