3-(4-methylphenyl)-4-propyl-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine

Systemtic Name: 3-(4-methylphenyl)-4-propyl-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine Openeye Name: 4-propyl-3-(p-tolyl)-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine CAS Name: 3-(4-methylphenyl)-4-propyl-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine IUPAC Name: 3-(4-methylphenyl)-4-propyl-1,4-dihydro-1,3,5-triazin-3-ium-2,6-diamine Traditional Name: [6-amino-4-propyl-3-(p-tolyl)-1,4-dihydro-s-triazin-3-ium-2-yl]amine Formula: C13H20N5+ MolecularWeight: 246.3314

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1N=C(NC(=[N+]1C2=CC=C(C=C2)C)N)N

Isomeric SMILES

CCCC1N=C(NC(=[N+]1C2=CC=C(C=C2)C)N)N

InChI

InChI=1S/C13H19N5/c1-3-4-11-16-12(14)17-13(15)18(11)10-7-5-9(2)6-8-10/h5-8,11H,3-4H2,1-2H3,(H4,14,15,16,17)/p+1