4-oxidanylidene-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide

Systemtic Name: 4-oxidanylidene-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Openeye Name: 4-oxo-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide CAS Name: 4-oxo-N-[[4-(3-phenylpropylamino)-2-quinazolinyl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide IUPAC Name: 4-oxo-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Traditional Name: 4-keto-N-[[4-(3-phenylpropylamino)quinazolin-2-yl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxamide Formula: C27H25N6O2+ MolecularWeight: 465.5264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC2=NC(=NC3=CC=CC=C32)CNC(=O)C4=CNC5=CC=CC=[N+]5C4=O

Isomeric SMILES

C1=CC=C(C=C1)CCCNC2=NC(=NC3=CC=CC=C32)CNC(=O)C4=CNC5=CC=CC=[N+]5C4=O

InChI

InChI=1S/C27H24N6O2/c34-26(21-17-29-24-14-6-7-16-33(24)27(21)35)30-18-23-31-22-13-5-4-12-20(22)25(32-23)28-15-8-11-19-9-2-1-3-10-19/h1-7,9-10,12-14,16-17H,8,11,15,18H2,(H2,28,30,31,32,34)/p+1