5,6-dimethyl-2-oxidanylidene-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyridine-3-carboxamide

Systemtic Name: 5,6-dimethyl-2-oxidanylidene-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyridine-3-carboxamide Openeye Name: 5,6-dimethyl-2-oxo-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyridine-3-carboxamide CAS Name: 5,6-dimethyl-2-oxo-N-[[4-(3-phenylpropylamino)-2-quinazolinyl]methyl]-1H-pyridine-3-carboxamide IUPAC Name: 5,6-dimethyl-2-oxo-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyridine-3-carboxamide Traditional Name: 2-keto-5,6-dimethyl-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyridine-3-carboxamide Formula: C26H27N5O2 MolecularWeight: 441.52488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=O)C(=C1)C(=O)NCC2=NC3=CC=CC=C3C(=N2)NCCCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(NC(=O)C(=C1)C(=O)NCC2=NC3=CC=CC=C3C(=N2)NCCCC4=CC=CC=C4)C

InChI

InChI=1S/C26H27N5O2/c1-17-15-21(26(33)29-18(17)2)25(32)28-16-23-30-22-13-7-6-12-20(22)24(31-23)27-14-8-11-19-9-4-3-5-10-19/h3-7,9-10,12-13,15H,8,11,14,16H2,1-2H3,(H,28,32)(H,29,33)(H,27,30,31)