N-[(3-methoxyphenyl)methyl]-3-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylamino]benzamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-3-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylamino]benzamide Openeye Name: N-[(3-methoxyphenyl)methyl]-3-[[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]methylamino]benzamide CAS Name: N-[(3-methoxyphenyl)methyl]-3-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylamino]benzamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-3-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylamino]benzamide Traditional Name: N-m-anisyl-3-[[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]methylamino]benzamide Formula: C23H22N6O2 MolecularWeight: 414.45978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C2=CC(=CC=C2)NCC3=NC(=NN3)C4=CC=NC=C4

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C2=CC(=CC=C2)NCC3=NC(=NN3)C4=CC=NC=C4

InChI

InChI=1S/C23H22N6O2/c1-31-20-7-2-4-16(12-20)14-26-23(30)18-5-3-6-19(13-18)25-15-21-27-22(29-28-21)17-8-10-24-11-9-17/h2-13,25H,14-15H2,1H3,(H,26,30)(H,27,28,29)