1-[4-(4-methylpiperazin-1-yl)quinazolin-2-yl]-2-(3-nitrophenyl)-2,3-dihydroquinazolin-4-one

Systemtic Name: 1-[4-(4-methylpiperazin-1-yl)quinazolin-2-yl]-2-(3-nitrophenyl)-2,3-dihydroquinazolin-4-one Openeye Name: 1-[4-(4-methylpiperazin-1-yl)quinazolin-2-yl]-2-(3-nitrophenyl)-2,3-dihydroquinazolin-4-one CAS Name: 1-[4-(4-methyl-1-piperazinyl)-2-quinazolinyl]-2-(3-nitrophenyl)-2,3-dihydroquinazolin-4-one IUPAC Name: 1-[4-(4-methylpiperazin-1-yl)quinazolin-2-yl]-2-(3-nitrophenyl)-2,3-dihydroquinazolin-4-one Traditional Name: 1-[4-(4-methylpiperazino)quinazolin-2-yl]-2-(3-nitrophenyl)-2,3-dihydroquinazolin-4-one Formula: C27H25N7O3 MolecularWeight: 495.5325

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC(=NC3=CC=CC=C32)N4C(NC(=O)C5=CC=CC=C54)C6=CC(=CC=C6)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=NC(=NC3=CC=CC=C32)N4C(NC(=O)C5=CC=CC=C54)C6=CC(=CC=C6)[N+](=O)[O-]

InChI

InChI=1S/C27H25N7O3/c1-31-13-15-32(16-14-31)25-20-9-2-4-11-22(20)28-27(30-25)33-23-12-5-3-10-21(23)26(35)29-24(33)18-7-6-8-19(17-18)34(36)37/h2-12,17,24H,13-16H2,1H3,(H,29,35)