2-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]quinazolin-4-amine dichloride

Systemtic Name: 2-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]quinazolin-4-amine dichloride Openeye Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)quinazolin-4-amine dichloride CAS Name: 2-[4-(diphenylmethyl)-1-piperazine-1,4-diiumyl]-4-quinazolinamine dichloride IUPAC Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)quinazolin-4-amine dichloride Traditional Name: [2-(4-benzhydrylpiperazine-1,4-diium-1-yl)quinazolin-4-yl]amine dichloride Formula: C25H27Cl2N5 MolecularWeight: 468.42138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1C2=NC3=CC=CC=C3C(=N2)N)C(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-].[Cl-]

Isomeric SMILES

C1C[NH+](CC[NH+]1C2=NC3=CC=CC=C3C(=N2)N)C(C4=CC=CC=C4)C5=CC=CC=C5.[Cl-].[Cl-]

InChI

InChI=1S/C25H25N5.2ClH/c26-24-21-13-7-8-14-22(21)27-25(28-24)30-17-15-29(16-18-30)23(19-9-3-1-4-10-19)20-11-5-2-6-12-20;;/h1-14,23H,15-18H2,(H2,26,27,28);2*1H