2-[(5E)-4-oxidanylidene-5-[(3-phenoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid

Systemtic Name: 2-[(5E)-4-oxidanylidene-5-[(3-phenoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid Openeye Name: 2-[(5E)-4-oxo-5-[(3-phenoxyphenyl)methylene]-2-thioxo-thiazolidin-3-yl]ethanesulfonic acid CAS Name: 2-[(5E)-4-oxo-5-[(3-phenoxyphenyl)methylidene]-2-sulfanylidene-3-thiazolidinyl]ethanesulfonic acid IUPAC Name: 2-[(5E)-4-oxo-5-[(3-phenoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanesulfonic acid Traditional Name: 2-[(5E)-4-keto-5-(3-phenoxybenzylidene)-2-thioxo-thiazolidin-3-yl]ethanesulfonic acid Formula: C18H15NO5S3 MolecularWeight: 421.5104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C=C3C(=O)N(C(=S)S3)CCS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)/C=C/3\C(=O)N(C(=S)S3)CCS(=O)(=O)O

InChI

InChI=1S/C18H15NO5S3/c20-17-16(26-18(25)19(17)9-10-27(21,22)23)12-13-5-4-8-15(11-13)24-14-6-2-1-3-7-14/h1-8,11-12H,9-10H2,(H,21,22,23)/b16-12+