3-[4-(4-methylphenyl)piperazin-1-yl]-N-[(4-oxidanylidene-3-phenyl-quinazolin-2-yl)methyl]propanamide

Systemtic Name: 3-[4-(4-methylphenyl)piperazin-1-yl]-N-[(4-oxidanylidene-3-phenyl-quinazolin-2-yl)methyl]propanamide Openeye Name: N-[(4-oxo-3-phenyl-quinazolin-2-yl)methyl]-3-[4-(p-tolyl)piperazin-1-yl]propanamide CAS Name: 3-[4-(4-methylphenyl)-1-piperazinyl]-N-[(4-oxo-3-phenyl-2-quinazolinyl)methyl]propanamide IUPAC Name: 3-[4-(4-methylphenyl)piperazin-1-yl]-N-[(4-oxo-3-phenylquinazolin-2-yl)methyl]propanamide Traditional Name: N-[(4-keto-3-phenyl-quinazolin-2-yl)methyl]-3-[4-(p-tolyl)piperazino]propionamide Formula: C29H31N5O2 MolecularWeight: 481.58874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)CCC(=O)NCC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)CCC(=O)NCC3=NC4=CC=CC=C4C(=O)N3C5=CC=CC=C5

InChI

InChI=1S/C29H31N5O2/c1-22-11-13-23(14-12-22)33-19-17-32(18-20-33)16-15-28(35)30-21-27-31-26-10-6-5-9-25(26)29(36)34(27)24-7-3-2-4-8-24/h2-14H,15-21H2,1H3,(H,30,35)