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

Systemtic Name: [5-[(4-methoxyphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-pyridin-4-yl-methanone Openeye Name: [5-[(4-methoxyphenyl)methylamino]-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(4-pyridyl)methanone CAS Name: [5-[(4-methoxyphenyl)methylamino]-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-pyridin-4-ylmethanone IUPAC Name: [5-[(4-methoxyphenyl)methylamino]-3-pyridin-3-yl-1,2,4-triazol-1-yl]-pyridin-4-ylmethanone Traditional Name: [5-(p-anisylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(4-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=CC=NC=C3)C4=CN=CC=C4

Isomeric SMILES

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

InChI

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