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

Systemtic Name: 4-[(2Z)-2-(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-benzothiazol-3-yl]butane-2-sulfonic acid Openeye Name: 4-[(2Z)-2-(3-ethyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)-1,3-benzothiazol-3-yl]butane-2-sulfonic acid CAS Name: 4-[(2Z)-2-(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)-1,3-benzothiazol-3-yl]-2-butanesulfonic acid IUPAC Name: 4-[(2Z)-2-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-benzothiazol-3-yl]butane-2-sulfonic acid Traditional Name: 4-[(2Z)-2-(3-ethyl-4-keto-2-thioxo-thiazolidin-5-ylidene)-1,3-benzothiazol-3-yl]butane-2-sulfonic acid Formula: C16H18N2O4S4 MolecularWeight: 430.58512

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=C2N(C3=CC=CC=C3S2)CCC(C)S(=O)(=O)O)SC1=S

Isomeric SMILES

CCN1C(=O)/C(=C/2\N(C3=CC=CC=C3S2)CCC(C)S(=O)(=O)O)/SC1=S

InChI

InChI=1S/C16H18N2O4S4/c1-3-17-14(19)13(25-16(17)23)15-18(9-8-10(2)26(20,21)22)11-6-4-5-7-12(11)24-15/h4-7,10H,3,8-9H2,1-2H3,(H,20,21,22)/b15-13-