3-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-pyridin-3-yl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-pyridin-3-yl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-(3-pyridyl)-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4-(3-pyridinyl)-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-pyridin-3-yl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-4-(3-pyridyl)-1H-1,2,4-triazol-5-one Formula: C16H14N4O3S MolecularWeight: 342.37236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=NNC(=O)N2C3=CN=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=NNC(=O)N2C3=CN=CC=C3

InChI

InChI=1S/C16H14N4O3S/c1-23-13-6-4-11(5-7-13)14(21)10-24-16-19-18-15(22)20(16)12-3-2-8-17-9-12/h2-9H,10H2,1H3,(H,18,22)