N2-phenyl-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-phenyl-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,3,5-triazine-2,4-diamine Openeye Name: N2-phenyl-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-phenyl-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-phenyl-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-s-triazin-2-yl]-phenyl-amine Formula: C19H21N6+ MolecularWeight: 333.41024

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC2=CC=CC=C21)CC3=NC(=NC(=N3)NC4=CC=CC=C4)N

Isomeric SMILES

C1C[NH+](CC2=CC=CC=C21)CC3=NC(=NC(=N3)NC4=CC=CC=C4)N

InChI

InChI=1S/C19H20N6/c20-18-22-17(23-19(24-18)21-16-8-2-1-3-9-16)13-25-11-10-14-6-4-5-7-15(14)12-25/h1-9H,10-13H2,(H3,20,21,22,23,24)/p+1