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

Systemtic Name: [5-[(4-methylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-phenyl-methanone Openeye Name: phenyl-[5-(p-tolylmethylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]methanone CAS Name: [5-[(4-methylphenyl)methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-phenylmethanone IUPAC Name: [5-[(4-methylphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-phenylmethanone Traditional Name: [5-[(4-methylbenzyl)amino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-phenyl-methanone Formula: C22H19N5O MolecularWeight: 369.41916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C22H19N5O/c1-16-9-11-17(12-10-16)14-24-22-25-20(19-8-5-13-23-15-19)26-27(22)21(28)18-6-3-2-4-7-18/h2-13,15H,14H2,1H3,(H,24,25,26)