1-(4-methoxyphenyl)-2-[(4-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(4-methoxyphenyl)-2-[(4-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 1-(4-methoxyphenyl)-2-[[4-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-(4-methoxyphenyl)-2-[[4-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-[(4-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 1-(4-methoxyphenyl)-2-[[4-(3-pyridyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C16H14N4O2S MolecularWeight: 326.37296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=NN=CN2C3=CN=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=NN=CN2C3=CN=CC=C3

InChI

InChI=1S/C16H14N4O2S/c1-22-14-6-4-12(5-7-14)15(21)10-23-16-19-18-11-20(16)13-3-2-8-17-9-13/h2-9,11H,10H2,1H3