N2-(2-methylphenyl)-6-(pyrrolidin-1-ium-1-ylmethyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(2-methylphenyl)-6-(pyrrolidin-1-ium-1-ylmethyl)-1,3,5-triazine-2,4-diamine Openeye Name: N2-(o-tolyl)-6-(pyrrolidin-1-ium-1-ylmethyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(2-methylphenyl)-6-(1-pyrrolidin-1-iumylmethyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(2-methylphenyl)-6-(pyrrolidin-1-ium-1-ylmethyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-(pyrrolidin-1-ium-1-ylmethyl)-s-triazin-2-yl]-(o-tolyl)amine Formula: C15H21N6+ MolecularWeight: 285.36744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)C[NH+]3CCCC3

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)C[NH+]3CCCC3

InChI

InChI=1S/C15H20N6/c1-11-6-2-3-7-12(11)17-15-19-13(18-14(16)20-15)10-21-8-4-5-9-21/h2-3,6-7H,4-5,8-10H2,1H3,(H3,16,17,18,19,20)/p+1