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

Systemtic Name: N-(phenylmethyl)-3-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylamino]benzamide Openeye Name: N-benzyl-3-[[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]methylamino]benzamide CAS Name: N-(phenylmethyl)-3-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylamino]benzamide IUPAC Name: N-benzyl-3-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methylamino]benzamide Traditional Name: N-benzyl-3-[[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]methylamino]benzamide Formula: C22H20N6O MolecularWeight: 384.4338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N6O/c29-22(25-14-16-5-2-1-3-6-16)18-7-4-8-19(13-18)24-15-20-26-21(28-27-20)17-9-11-23-12-10-17/h1-13,24H,14-15H2,(H,25,29)(H,26,27,28)