S-[4-oxidanylidene-1-(4-phenylphenyl)-4-(1,2-thiazolidin-2-yl)butyl] ethanethioate

Systemtic Name: S-[4-oxidanylidene-1-(4-phenylphenyl)-4-(1,2-thiazolidin-2-yl)butyl] ethanethioate Openeye Name: S-[4-isothiazolidin-2-yl-4-oxo-1-(4-phenylphenyl)butyl] ethanethioate CAS Name: ethanethioic acid S-[4-(2-isothiazolidinyl)-4-oxo-1-(4-phenylphenyl)butyl] ester IUPAC Name: S-[4-oxo-1-(4-phenylphenyl)-4-(1,2-thiazolidin-2-yl)butyl] ethanethioate Traditional Name: ethanethioic acid S-[4-isothiazolidin-2-yl-4-keto-1-(4-phenylphenyl)butyl] ester Formula: C21H23NO2S2 MolecularWeight: 385.54282

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CCC(=O)N1CCCS1)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)SC(CCC(=O)N1CCCS1)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO2S2/c1-16(23)26-20(12-13-21(24)22-14-5-15-25-22)19-10-8-18(9-11-19)17-6-3-2-4-7-17/h2-4,6-11,20H,5,12-15H2,1H3