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

Systemtic Name: [5-[(phenylmethyl)amino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-pyridin-3-yl-methanone Openeye Name: [5-(benzylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(3-pyridyl)methanone CAS Name: [5-[(phenylmethyl)amino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-(3-pyridinyl)methanone IUPAC Name: [5-(benzylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]-pyridin-3-ylmethanone Traditional Name: [5-(benzylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(3-pyridyl)methanone Formula: C20H16N6O MolecularWeight: 356.38064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16N6O/c27-19(17-9-5-11-22-14-17)26-20(23-12-15-6-2-1-3-7-15)24-18(25-26)16-8-4-10-21-13-16/h1-11,13-14H,12H2,(H,23,24,25)