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

Systemtic Name: 3-[4-(4-nitrophenyl)piperazin-1-yl]-N-[(4-oxidanylidene-3-phenyl-quinazolin-2-yl)methyl]propanamide Openeye Name: 3-[4-(4-nitrophenyl)piperazin-1-yl]-N-[(4-oxo-3-phenyl-quinazolin-2-yl)methyl]propanamide CAS Name: 3-[4-(4-nitrophenyl)-1-piperazinyl]-N-[(4-oxo-3-phenyl-2-quinazolinyl)methyl]propanamide IUPAC Name: 3-[4-(4-nitrophenyl)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-(4-nitrophenyl)piperazino]propionamide Formula: C28H28N6O4 MolecularWeight: 512.55972

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NCC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CCC(=O)NCC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H28N6O4/c35-27(14-15-31-16-18-32(19-17-31)21-10-12-23(13-11-21)34(37)38)29-20-26-30-25-9-5-4-8-24(25)28(36)33(26)22-6-2-1-3-7-22/h1-13H,14-20H2,(H,29,35)