(4E)-2-(4-ethanoyl-3-ethoxy-5-oxidanyl-phenyl)-1,1-bis(ethylsulfanyl)-5-pyridin-2-yl-penta-1,4-dien-3-one

Systemtic Name: (4E)-2-(4-ethanoyl-3-ethoxy-5-oxidanyl-phenyl)-1,1-bis(ethylsulfanyl)-5-pyridin-2-yl-penta-1,4-dien-3-one Openeye Name: (4E)-2-(4-acetyl-3-ethoxy-5-hydroxy-phenyl)-1,1-bis(ethylsulfanyl)-5-(2-pyridyl)penta-1,4-dien-3-one CAS Name: (4E)-2-(4-acetyl-3-ethoxy-5-hydroxyphenyl)-1,1-bis(ethylthio)-5-(2-pyridinyl)-3-penta-1,4-dienone IUPAC Name: (4E)-2-(4-acetyl-3-ethoxy-5-hydroxyphenyl)-1,1-bis(ethylsulfanyl)-5-pyridin-2-ylpenta-1,4-dien-3-one Traditional Name: (4E)-2-(4-acetyl-3-ethoxy-5-hydroxy-phenyl)-1,1-bis(ethylthio)-5-(2-pyridyl)penta-1,4-dien-3-one Formula: C24H27NO4S2 MolecularWeight: 457.60548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1C(=O)C)O)C(=C(SCC)SCC)C(=O)C=CC2=CC=CC=N2

Isomeric SMILES

CCOC1=CC(=CC(=C1C(=O)C)O)C(=C(SCC)SCC)C(=O)/C=C/C2=CC=CC=N2

InChI

InChI=1S/C24H27NO4S2/c1-5-29-21-15-17(14-20(28)22(21)16(4)26)23(24(30-6-2)31-7-3)19(27)12-11-18-10-8-9-13-25-18/h8-15,28H,5-7H2,1-4H3/b12-11+