ethyl (Z)-5-oxidanylidene-2-phenethylsulfanyl-5-phenyl-pent-2-enoate

Systemtic Name: ethyl (Z)-5-oxidanylidene-2-phenethylsulfanyl-5-phenyl-pent-2-enoate Openeye Name: ethyl (Z)-5-oxo-2-phenethylsulfanyl-5-phenyl-pent-2-enoate CAS Name: (Z)-5-oxo-2-(phenethylthio)-5-phenyl-2-pentenoic acid ethyl ester IUPAC Name: ethyl (Z)-5-oxo-2-phenethylsulfanyl-5-phenylpent-2-enoate Traditional Name: (Z)-5-keto-2-(phenethylthio)-5-phenyl-pent-2-enoic acid ethyl ester Formula: C21H22O3S MolecularWeight: 354.46258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CCC(=O)C1=CC=CC=C1)SCCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C(=C/CC(=O)C1=CC=CC=C1)/SCCC2=CC=CC=C2

InChI

InChI=1S/C21H22O3S/c1-2-24-21(23)20(25-16-15-17-9-5-3-6-10-17)14-13-19(22)18-11-7-4-8-12-18/h3-12,14H,2,13,15-16H2,1H3/b20-14-