4-[[4-(diphenylmethyl)piperazin-1-ium-1-yl]methyl]-6-morpholin-4-yl-1,3,5-triazin-2-amine

Systemtic Name: 4-[[4-(diphenylmethyl)piperazin-1-ium-1-yl]methyl]-6-morpholin-4-yl-1,3,5-triazin-2-amine Openeye Name: 4-[(4-benzhydrylpiperazin-1-ium-1-yl)methyl]-6-morpholino-1,3,5-triazin-2-amine CAS Name: 4-[[4-(diphenylmethyl)-1-piperazin-1-iumyl]methyl]-6-(4-morpholinyl)-1,3,5-triazin-2-amine IUPAC Name: 4-[(4-benzhydrylpiperazin-1-ium-1-yl)methyl]-6-morpholin-4-yl-1,3,5-triazin-2-amine Traditional Name: [4-[(4-benzhydrylpiperazin-1-ium-1-yl)methyl]-6-morpholino-s-triazin-2-yl]amine Formula: C25H32N7O+ MolecularWeight: 446.56788

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC(=NC(=N2)N)N3CCOCC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC(=NC(=N2)N)N3CCOCC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H31N7O/c26-24-27-22(28-25(29-24)32-15-17-33-18-16-32)19-30-11-13-31(14-12-30)23(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-10,23H,11-19H2,(H2,26,27,28,29)/p+1