6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N2-(3-methoxyphenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N2-(3-methoxyphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N2-(3-methoxyphenyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N2-(3-methoxyphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-N-(3-methoxyphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-s-triazin-2-yl]-(3-methoxyphenyl)amine Formula: C20H22N6O MolecularWeight: 362.42828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC(=NC(=N2)N)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC(=NC(=N2)N)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C20H22N6O/c1-27-17-8-4-7-16(11-17)22-20-24-18(23-19(21)25-20)13-26-10-9-14-5-2-3-6-15(14)12-26/h2-8,11H,9-10,12-13H2,1H3,(H3,21,22,23,24,25)