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

Systemtic Name: 3-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4-phenyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-4-phenyl-1H-1,2,4-triazol-5-one Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O3S/c1-23-14-9-7-12(8-10-14)15(21)11-24-17-19-18-16(22)20(17)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,18,22)