N2-butyl-6-(1H-imidazol-3-ium-3-yl)-N4,N4-diphenyl-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-butyl-6-(1H-imidazol-3-ium-3-yl)-N4,N4-diphenyl-1,3,5-triazine-2,4-diamine Openeye Name: N2-butyl-6-(1H-imidazol-3-ium-3-yl)-N4,N4-diphenyl-1,3,5-triazine-2,4-diamine CAS Name: N2-butyl-6-(1H-imidazol-3-ium-3-yl)-N4,N4-diphenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-butyl-6-(1H-imidazol-3-ium-3-yl)-4-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-(butylamino)-6-(1H-imidazol-3-ium-3-yl)-s-triazin-2-yl]-diphenyl-amine Formula: C22H24N7+ MolecularWeight: 386.47286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=NC(=N1)[N+]2=CNC=C2)N(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCNC1=NC(=NC(=N1)[N+]2=CNC=C2)N(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N7/c1-2-3-14-24-20-25-21(28-16-15-23-17-28)27-22(26-20)29(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-13,15-17H,2-3,14H2,1H3,(H,24,25,26,27)/p+1