5-(2,4-dimethoxyphenyl)-N-[(4-morpholin-4-ylphenyl)methyl]-1,2,4-triazin-3-amine

Systemtic Name: 5-(2,4-dimethoxyphenyl)-N-[(4-morpholin-4-ylphenyl)methyl]-1,2,4-triazin-3-amine Openeye Name: 5-(2,4-dimethoxyphenyl)-N-[(4-morpholinophenyl)methyl]-1,2,4-triazin-3-amine CAS Name: 5-(2,4-dimethoxyphenyl)-N-[[4-(4-morpholinyl)phenyl]methyl]-1,2,4-triazin-3-amine IUPAC Name: 5-(2,4-dimethoxyphenyl)-N-[(4-morpholin-4-ylphenyl)methyl]-1,2,4-triazin-3-amine Traditional Name: [5-(2,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]-(4-morpholinobenzyl)amine Formula: C22H25N5O3 MolecularWeight: 407.4656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CN=NC(=N2)NCC3=CC=C(C=C3)N4CCOCC4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CN=NC(=N2)NCC3=CC=C(C=C3)N4CCOCC4)OC

InChI

InChI=1S/C22H25N5O3/c1-28-18-7-8-19(21(13-18)29-2)20-15-24-26-22(25-20)23-14-16-3-5-17(6-4-16)27-9-11-30-12-10-27/h3-8,13,15H,9-12,14H2,1-2H3,(H,23,25,26)