2,6-bis(azepan-1-yl)-N-[(Z)-(4-nitrophenyl)methylideneamino]pyrimidin-4-amine

Systemtic Name: 2,6-bis(azepan-1-yl)-N-[(Z)-(4-nitrophenyl)methylideneamino]pyrimidin-4-amine Openeye Name: 2,6-bis(azepan-1-yl)-N-[(Z)-(4-nitrophenyl)methyleneamino]pyrimidin-4-amine CAS Name: 2,6-bis(1-azepanyl)-N-[(Z)-(4-nitrophenyl)methylideneamino]-4-pyrimidinamine IUPAC Name: 2,6-bis(azepan-1-yl)-N-[(Z)-(4-nitrophenyl)methylideneamino]pyrimidin-4-amine Traditional Name: [2,6-bis(azepan-1-yl)pyrimidin-4-yl]-[(Z)-(4-nitrobenzylidene)amino]amine Formula: C23H31N7O2 MolecularWeight: 437.53794

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=NC(=N2)N3CCCCCC3)NN=CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=CC(=NC(=N2)N3CCCCCC3)N/N=C\C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H31N7O2/c31-30(32)20-11-9-19(10-12-20)18-24-27-21-17-22(28-13-5-1-2-6-14-28)26-23(25-21)29-15-7-3-4-8-16-29/h9-12,17-18H,1-8,13-16H2,(H,25,26,27)/b24-18-