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

Systemtic Name: 1-[5-[(4-methylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-2-naphthalen-1-yl-ethanone Openeye Name: 2-(1-naphthyl)-1-[5-(p-tolylmethylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]ethanone CAS Name: 1-[5-[(4-methylphenyl)methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-2-(1-naphthalenyl)ethanone IUPAC Name: 1-[5-[(4-methylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-2-naphthalen-1-ylethanone Traditional Name: 1-[5-[(4-methylbenzyl)amino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-2-(1-naphthyl)ethanone Formula: C27H23N5O MolecularWeight: 433.50442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC(=NN2C(=O)CC3=CC=CC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC(=NN2C(=O)CC3=CC=CC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C27H23N5O/c1-19-11-13-20(14-12-19)17-29-27-30-26(23-9-5-15-28-18-23)31-32(27)25(33)16-22-8-4-7-21-6-2-3-10-24(21)22/h2-15,18H,16-17H2,1H3,(H,29,30,31)