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

Systemtic Name: 1-[3,5-bis[(4-methylphenyl)methylamino]-1,2,4-triazol-1-yl]ethanone Openeye Name: 1-[3,5-bis(p-tolylmethylamino)-1,2,4-triazol-1-yl]ethanone CAS Name: 1-[3,5-bis[(4-methylphenyl)methylamino]-1,2,4-triazol-1-yl]ethanone IUPAC Name: 1-[3,5-bis[(4-methylphenyl)methylamino]-1,2,4-triazol-1-yl]ethanone Traditional Name: 1-[3,5-bis[(4-methylbenzyl)amino]-1,2,4-triazol-1-yl]ethanone Formula: C20H23N5O MolecularWeight: 349.42952

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O/c1-14-4-8-17(9-5-14)12-21-19-23-20(25(24-19)16(3)26)22-13-18-10-6-15(2)7-11-18/h4-11H,12-13H2,1-3H3,(H2,21,22,23,24)