S-[2-[2-(2,5-dimethoxyphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]ethyl] benzenecarbothioate

Systemtic Name: S-[2-[2-(2,5-dimethoxyphenyl)-4-oxidanylidene-1,3-thiazolidin-3-yl]ethyl] benzenecarbothioate Openeye Name: S-[2-[2-(2,5-dimethoxyphenyl)-4-oxo-thiazolidin-3-yl]ethyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-[2-(2,5-dimethoxyphenyl)-4-oxo-3-thiazolidinyl]ethyl] ester IUPAC Name: S-[2-[2-(2,5-dimethoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]ethyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-[2-(2,5-dimethoxyphenyl)-4-keto-thiazolidin-3-yl]ethyl] ester Formula: C20H21NO4S2 MolecularWeight: 403.51504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2N(C(=O)CS2)CCSC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2N(C(=O)CS2)CCSC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21NO4S2/c1-24-15-8-9-17(25-2)16(12-15)19-21(18(22)13-27-19)10-11-26-20(23)14-6-4-3-5-7-14/h3-9,12,19H,10-11,13H2,1-2H3