[5-[(4-methoxyphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [5-[(4-methoxyphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-pyridin-3-yl-methanone Openeye Name: [5-[(4-methoxyphenyl)methylamino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(3-pyridyl)methanone CAS Name: [5-[(4-methoxyphenyl)methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-(3-pyridinyl)methanone IUPAC Name: [5-[(4-methoxyphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-pyridin-3-ylmethanone Traditional Name: [5-(p-anisylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(3-pyridyl)methanone Formula: C21H18N6O2 MolecularWeight: 386.40662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C3=CN=CC=C3)C4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=NC(=NN2C(=O)C3=CN=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C21H18N6O2/c1-29-18-8-6-15(7-9-18)12-24-21-25-19(16-4-2-10-22-13-16)26-27(21)20(28)17-5-3-11-23-14-17/h2-11,13-14H,12H2,1H3,(H,24,25,26)