(5-azanyl-3-pyridin-3-yl-1,2,4-triazol-1-yl)-(3,4-dimethoxyphenyl)methanone

Systemtic Name: (5-azanyl-3-pyridin-3-yl-1,2,4-triazol-1-yl)-(3,4-dimethoxyphenyl)methanone Openeye Name: [5-amino-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(3,4-dimethoxyphenyl)methanone CAS Name: [5-amino-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-(3,4-dimethoxyphenyl)methanone IUPAC Name: (5-amino-3-pyridin-3-yl-1,2,4-triazol-1-yl)-(3,4-dimethoxyphenyl)methanone Traditional Name: [5-amino-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(3,4-dimethoxyphenyl)methanone Formula: C16H15N5O3 MolecularWeight: 325.322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2C(=NC(=N2)C3=CN=CC=C3)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2C(=NC(=N2)C3=CN=CC=C3)N)OC

InChI

InChI=1S/C16H15N5O3/c1-23-12-6-5-10(8-13(12)24-2)15(22)21-16(17)19-14(20-21)11-4-3-7-18-9-11/h3-9H,1-2H3,(H2,17,19,20)