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

Systemtic Name: 4-[3-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[3-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[3-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4-phenyl-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[3-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[3-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-4-phenyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=NNC(=C3C=CC(=O)C=C3)N2C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=NNC(=C3C=CC(=O)C=C3)N2C4=CC=CC=C4

InChI

InChI=1S/C23H19N3O3S/c1-29-20-13-9-16(10-14-20)21(28)15-30-23-25-24-22(17-7-11-19(27)12-8-17)26(23)18-5-3-2-4-6-18/h2-14,24H,15H2,1H3