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

Systemtic Name: 1-[5-[(4-phenylmethoxyphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]ethanone Openeye Name: 1-[5-[(4-benzyloxyphenyl)methylamino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]ethanone CAS Name: 1-[5-[(4-phenylmethoxyphenyl)methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]ethanone IUPAC Name: 1-[5-[(4-phenylmethoxyphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]ethanone Traditional Name: 1-[5-[(4-benzoxybenzyl)amino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]ethanone Formula: C23H21N5O2 MolecularWeight: 399.44514

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=NC(=N1)C2=CN=CC=C2)NCC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1C(=NC(=N1)C2=CN=CC=C2)NCC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H21N5O2/c1-17(29)28-23(26-22(27-28)20-8-5-13-24-15-20)25-14-18-9-11-21(12-10-18)30-16-19-6-3-2-4-7-19/h2-13,15H,14,16H2,1H3,(H,25,26,27)