S-[4-[2-cyclopentyl-1-(4-ethanoylsulfanylphenyl)but-1-enyl]phenyl] ethanethioate

Systemtic Name: S-[4-[2-cyclopentyl-1-(4-ethanoylsulfanylphenyl)but-1-enyl]phenyl] ethanethioate Openeye Name: S-[4-[1-(4-acetylsulfanylphenyl)-2-cyclopentyl-but-1-enyl]phenyl] ethanethioate CAS Name: ethanethioic acid S-[4-[1-[4-(acetylthio)phenyl]-2-cyclopentylbut-1-enyl]phenyl] ester IUPAC Name: S-[4-[1-(4-acetylsulfanylphenyl)-2-cyclopentylbut-1-enyl]phenyl] ethanethioate Traditional Name: ethanethioic acid S-[4-[1-[4-(acetylthio)phenyl]-2-cyclopentyl-but-1-enyl]phenyl] ester Formula: C25H23O2S2 MolecularWeight: 419.57892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=C(C=C1)SC(=O)C)C2=CC=C(C=C2)SC(=O)C)[C]3[CH][CH][CH][CH]3

Isomeric SMILES

CCC(=C(C1=CC=C(C=C1)SC(=O)C)C2=CC=C(C=C2)SC(=O)C)[C]3[CH][CH][CH][CH]3

InChI

InChI=1S/C25H23O2S2/c1-4-24(19-7-5-6-8-19)25(20-9-13-22(14-10-20)28-17(2)26)21-11-15-23(16-12-21)29-18(3)27/h5-16H,4H2,1-3H3