[4-azanyl-6-[(2-ethylphenyl)amino]-1,3,5-triazin-2-yl]methyl-ethyl-(phenylmethyl)azanium

Systemtic Name: [4-azanyl-6-[(2-ethylphenyl)amino]-1,3,5-triazin-2-yl]methyl-ethyl-(phenylmethyl)azanium Openeye Name: [4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methyl-benzyl-ethyl-ammonium CAS Name: [4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methyl-ethyl-(phenylmethyl)ammonium IUPAC Name: [4-amino-6-(2-ethylanilino)-1,3,5-triazin-2-yl]methyl-benzyl-ethylazanium Traditional Name: [4-amino-6-(2-ethylanilino)-s-triazin-2-yl]methyl-benzyl-ethyl-ammonium Formula: C21H27N6+ MolecularWeight: 363.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)C[NH+](CC)CC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC(=NC(=N2)N)C[NH+](CC)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N6/c1-3-17-12-8-9-13-18(17)23-21-25-19(24-20(22)26-21)15-27(4-2)14-16-10-6-5-7-11-16/h5-13H,3-4,14-15H2,1-2H3,(H3,22,23,24,25,26)/p+1