3-[2-(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)quinolin-1-yl]propane-1-sulfonate

Systemtic Name: 3-[2-(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)quinolin-1-yl]propane-1-sulfonate Openeye Name: 3-[2-(3-ethyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)-1-quinolyl]propane-1-sulfonate CAS Name: 3-[2-(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)-1-quinolinyl]-1-propanesulfonate IUPAC Name: 3-[2-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)quinolin-1-yl]propane-1-sulfonate Traditional Name: 3-[2-(3-ethyl-4-keto-2-thioxo-thiazolidin-5-ylidene)-1-quinolyl]propane-1-sulfonate Formula: C17H17N2O4S3- MolecularWeight: 409.52288

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C2C=CC3=CC=CC=C3N2CCCS(=O)(=O)[O-])SC1=S

Isomeric SMILES

CCN1C(=O)C(=C2C=CC3=CC=CC=C3N2CCCS(=O)(=O)[O-])SC1=S

InChI

InChI=1S/C17H18N2O4S3/c1-2-18-16(20)15(25-17(18)24)14-9-8-12-6-3-4-7-13(12)19(14)10-5-11-26(21,22)23/h3-4,6-9H,2,5,10-11H2,1H3,(H,21,22,23)/p-1