2-phenoxy-1-[5-[(phenylmethyl)amino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]ethanone

Systemtic Name: 2-phenoxy-1-[5-[(phenylmethyl)amino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]ethanone Openeye Name: 1-[5-(benzylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-2-phenoxy-ethanone CAS Name: 2-phenoxy-1-[5-[(phenylmethyl)amino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]ethanone IUPAC Name: 1-[5-(benzylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]-2-phenoxyethanone Traditional Name: 1-[5-(benzylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-2-phenoxy-ethanone Formula: C22H19N5O2 MolecularWeight: 385.41856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NN2C(=O)COC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NN2C(=O)COC3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C22H19N5O2/c28-20(16-29-19-11-5-2-6-12-19)27-22(24-14-17-8-3-1-4-9-17)25-21(26-27)18-10-7-13-23-15-18/h1-13,15H,14,16H2,(H,24,25,26)