6-(3-methylbutyl)-2-[(4-phenylquinazolin-2-yl)amino]-1H-pyrimidin-4-one

Systemtic Name: 6-(3-methylbutyl)-2-[(4-phenylquinazolin-2-yl)amino]-1H-pyrimidin-4-one Openeye Name: 6-isopentyl-2-[(4-phenylquinazolin-2-yl)amino]-1H-pyrimidin-4-one CAS Name: 6-(3-methylbutyl)-2-[(4-phenyl-2-quinazolinyl)amino]-1H-pyrimidin-4-one IUPAC Name: 6-(3-methylbutyl)-2-[(4-phenylquinazolin-2-yl)amino]-1H-pyrimidin-4-one Traditional Name: 6-isoamyl-2-[(4-phenylquinazolin-2-yl)amino]-1H-pyrimidin-4-one Formula: C23H23N5O MolecularWeight: 385.46162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=CC(=O)N=C(N1)NC2=NC3=CC=CC=C3C(=N2)C4=CC=CC=C4

Isomeric SMILES

CC(C)CCC1=CC(=O)N=C(N1)NC2=NC3=CC=CC=C3C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C23H23N5O/c1-15(2)12-13-17-14-20(29)26-22(24-17)28-23-25-19-11-7-6-10-18(19)21(27-23)16-8-4-3-5-9-16/h3-11,14-15H,12-13H2,1-2H3,(H2,24,25,26,27,28,29)