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

Systemtic Name: 1-[3,5-bis[(4-methylphenyl)methylamino]-1,2,4-triazol-1-yl]-2-phenyl-ethanone Openeye Name: 1-[3,5-bis(p-tolylmethylamino)-1,2,4-triazol-1-yl]-2-phenyl-ethanone CAS Name: 1-[3,5-bis[(4-methylphenyl)methylamino]-1,2,4-triazol-1-yl]-2-phenylethanone IUPAC Name: 1-[3,5-bis[(4-methylphenyl)methylamino]-1,2,4-triazol-1-yl]-2-phenylethanone Traditional Name: 1-[3,5-bis[(4-methylbenzyl)amino]-1,2,4-triazol-1-yl]-2-phenyl-ethanone Formula: C26H27N5O MolecularWeight: 425.52548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=C(C=C3)C)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=C(C=C3)C)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C26H27N5O/c1-19-8-12-22(13-9-19)17-27-25-29-26(28-18-23-14-10-20(2)11-15-23)31(30-25)24(32)16-21-6-4-3-5-7-21/h3-15H,16-18H2,1-2H3,(H2,27,28,29,30)