3-[(2Z)-2-[3-(carboxymethyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1,3-benzothiazol-3-yl]propane-1-sulfonate

Systemtic Name: 3-[(2Z)-2-[3-(carboxymethyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1,3-benzothiazol-3-yl]propane-1-sulfonate Openeye Name: 3-[(2Z)-2-[3-(carboxymethyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]-1,3-benzothiazol-3-yl]propane-1-sulfonate CAS Name: 3-[(2Z)-2-[3-(carboxymethyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]-1,3-benzothiazol-3-yl]-1-propanesulfonate IUPAC Name: 3-[(2Z)-2-[3-(carboxymethyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]-1,3-benzothiazol-3-yl]propane-1-sulfonate Traditional Name: 3-[(2Z)-2-[3-(carboxymethyl)-4-keto-2-thioxo-thiazolidin-5-ylidene]-1,3-benzothiazol-3-yl]propane-1-sulfonate Formula: C15H13N2O6S4- MolecularWeight: 445.53352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=C3C(=O)N(C(=S)S3)CC(=O)O)S2)CCCS(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N(/C(=C/3\C(=O)N(C(=S)S3)CC(=O)O)/S2)CCCS(=O)(=O)[O-]

InChI

InChI=1S/C15H14N2O6S4/c18-11(19)8-17-13(20)12(26-15(17)24)14-16(6-3-7-27(21,22)23)9-4-1-2-5-10(9)25-14/h1-2,4-5H,3,6-8H2,(H,18,19)(H,21,22,23)/p-1/b14-12-