S-[5-oxidanylidene-1-[(4-phenylsulfanylphenyl)methyl]pyrrolidin-3-yl] ethanethioate

Systemtic Name: S-[5-oxidanylidene-1-[(4-phenylsulfanylphenyl)methyl]pyrrolidin-3-yl] ethanethioate Openeye Name: S-[5-oxo-1-[(4-phenylsulfanylphenyl)methyl]pyrrolidin-3-yl] ethanethioate CAS Name: ethanethioic acid S-[5-oxo-1-[[4-(phenylthio)phenyl]methyl]-3-pyrrolidinyl] ester IUPAC Name: S-[5-oxo-1-[(4-phenylsulfanylphenyl)methyl]pyrrolidin-3-yl] ethanethioate Traditional Name: ethanethioic acid S-[5-keto-1-[4-(phenylthio)benzyl]pyrrolidin-3-yl] ester Formula: C19H19NO2S2 MolecularWeight: 357.48966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CC(=O)N(C1)CC2=CC=C(C=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(=O)SC1CC(=O)N(C1)CC2=CC=C(C=C2)SC3=CC=CC=C3

InChI

InChI=1S/C19H19NO2S2/c1-14(21)23-18-11-19(22)20(13-18)12-15-7-9-17(10-8-15)24-16-5-3-2-4-6-16/h2-10,18H,11-13H2,1H3