N'-(6-nitro-7-piperazin-1-yl-quinazolin-2-yl)-N-phenyl-ethane-1,2-diamine

Systemtic Name: N'-(6-nitro-7-piperazin-1-yl-quinazolin-2-yl)-N-phenyl-ethane-1,2-diamine Openeye Name: N'-(6-nitro-7-piperazin-1-yl-quinazolin-2-yl)-N-phenyl-ethane-1,2-diamine CAS Name: N'-[6-nitro-7-(1-piperazinyl)-2-quinazolinyl]-N-phenylethane-1,2-diamine IUPAC Name: N'-(6-nitro-7-piperazin-1-ylquinazolin-2-yl)-N-phenylethane-1,2-diamine Traditional Name: 2-anilinoethyl-(6-nitro-7-piperazino-quinazolin-2-yl)amine Formula: C20H23N7O2 MolecularWeight: 393.44232

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C3C=NC(=NC3=C2)NCCNC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=C(C=C3C=NC(=NC3=C2)NCCNC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H23N7O2/c28-27(29)19-12-15-14-24-20(23-7-6-22-16-4-2-1-3-5-16)25-17(15)13-18(19)26-10-8-21-9-11-26/h1-5,12-14,21-22H,6-11H2,(H,23,24,25)