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

Systemtic Name: 2,6-bis(azepan-1-yl)-N-[(Z)-(phenylmethylidene)amino]pyrimidin-4-amine Openeye Name: 2,6-bis(azepan-1-yl)-N-[(Z)-benzylideneamino]pyrimidin-4-amine CAS Name: 2,6-bis(1-azepanyl)-N-[(Z)-(phenylmethylene)amino]-4-pyrimidinamine IUPAC Name: 2,6-bis(azepan-1-yl)-N-[(Z)-benzylideneamino]pyrimidin-4-amine Traditional Name: [(Z)-benzalamino]-[2,6-bis(azepan-1-yl)pyrimidin-4-yl]amine Formula: C23H32N6 MolecularWeight: 392.54038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC(=NC(=N2)N3CCCCCC3)NN=CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=CC(=NC(=N2)N3CCCCCC3)N/N=C\C4=CC=CC=C4

InChI

InChI=1S/C23H32N6/c1-2-9-15-28(14-8-1)22-18-21(27-24-19-20-12-6-5-7-13-20)25-23(26-22)29-16-10-3-4-11-17-29/h5-7,12-13,18-19H,1-4,8-11,14-17H2,(H,25,26,27)/b24-19-