1-[3,5-bis[(2-methoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[3,5-bis[(2-methoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[3,5-bis[(2-methoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-2-methyl-propan-1-one CAS Name: 1-[3,5-bis[(2-methoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-2-methyl-1-propanone IUPAC Name: 1-[3,5-bis[(2-methoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-2-methylpropan-1-one Traditional Name: 1-[3,5-bis(o-anisylamino)-1,2,4-triazol-1-yl]-2-methyl-propan-1-one Formula: C22H27N5O3 MolecularWeight: 409.48148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C(=NC(=N1)NCC2=CC=CC=C2OC)NCC3=CC=CC=C3OC

Isomeric SMILES

CC(C)C(=O)N1C(=NC(=N1)NCC2=CC=CC=C2OC)NCC3=CC=CC=C3OC

InChI

InChI=1S/C22H27N5O3/c1-15(2)20(28)27-22(24-14-17-10-6-8-12-19(17)30-4)25-21(26-27)23-13-16-9-5-7-11-18(16)29-3/h5-12,15H,13-14H2,1-4H3,(H2,23,24,25,26)