3-[(2Z)-2-(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-5-methylsulfanyl-1,3,4-thiadiazol-3-yl]propane-1-sulfonic acid

Systemtic Name: 3-[(2Z)-2-(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-5-methylsulfanyl-1,3,4-thiadiazol-3-yl]propane-1-sulfonic acid Openeye Name: 3-[(2Z)-2-(3-ethyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)-5-methylsulfanyl-1,3,4-thiadiazol-3-yl]propane-1-sulfonic acid CAS Name: 3-[(2Z)-2-(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)-5-(methylthio)-1,3,4-thiadiazol-3-yl]-1-propanesulfonic acid IUPAC Name: 3-[(2Z)-2-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-5-methylsulfanyl-1,3,4-thiadiazol-3-yl]propane-1-sulfonic acid Traditional Name: 3-[(2Z)-2-(3-ethyl-4-keto-2-thioxo-thiazolidin-5-ylidene)-5-(methylthio)-1,3,4-thiadiazol-3-yl]propane-1-sulfonic acid Formula: C11H15N3O4S5 MolecularWeight: 413.5795

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C2N(N=C(S2)SC)CCCS(=O)(=O)O)SC1=S

Isomeric SMILES

CCN1C(=O)/C(=C/2\N(N=C(S2)SC)CCCS(=O)(=O)O)/SC1=S

InChI

InChI=1S/C11H15N3O4S5/c1-3-13-8(15)7(21-11(13)19)9-14(12-10(20-2)22-9)5-4-6-23(16,17)18/h3-6H2,1-2H3,(H,16,17,18)/b9-7-