[3-(3,4-dimethoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [3-(3,4-dimethoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-pyridin-3-yl-methanone Openeye Name: [3-(3,4-dimethoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-(3-pyridyl)methanone CAS Name: [3-(3,4-dimethoxyphenyl)-5-(methylthio)-1,2,4-triazol-1-yl]-(3-pyridinyl)methanone IUPAC Name: [3-(3,4-dimethoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]-pyridin-3-ylmethanone Traditional Name: [3-(3,4-dimethoxyphenyl)-5-(methylthio)-1,2,4-triazol-1-yl]-(3-pyridyl)methanone Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=N2)SC)C(=O)C3=CN=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=N2)SC)C(=O)C3=CN=CC=C3)OC

InChI

InChI=1S/C17H16N4O3S/c1-23-13-7-6-11(9-14(13)24-2)15-19-17(25-3)21(20-15)16(22)12-5-4-8-18-10-12/h4-10H,1-3H3