1-[3,5-bis[(2-methoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-2-phenyl-ethanone

Systemtic Name: 1-[3,5-bis[(2-methoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-2-phenyl-ethanone Openeye Name: 1-[3,5-bis[(2-methoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-2-phenyl-ethanone CAS Name: 1-[3,5-bis[(2-methoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-2-phenylethanone IUPAC Name: 1-[3,5-bis[(2-methoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-2-phenylethanone Traditional Name: 1-[3,5-bis(o-anisylamino)-1,2,4-triazol-1-yl]-2-phenyl-ethanone Formula: C26H27N5O3 MolecularWeight: 457.52428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC2=NN(C(=N2)NCC3=CC=CC=C3OC)C(=O)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1CNC2=NN(C(=N2)NCC3=CC=CC=C3OC)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C26H27N5O3/c1-33-22-14-8-6-12-20(22)17-27-25-29-26(28-18-21-13-7-9-15-23(21)34-2)31(30-25)24(32)16-19-10-4-3-5-11-19/h3-15H,16-18H2,1-2H3,(H2,27,28,29,30)