4-[(5E)-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid

Systemtic Name: 4-[(5E)-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid Openeye Name: 4-[(5E)-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]benzoic acid CAS Name: 4-[(5E)-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]benzoic acid IUPAC Name: 4-[(5E)-5-(3-methyl-1,3-benzothiazol-2-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid Traditional Name: 4-[(5E)-4-keto-5-(3-methyl-1,3-benzothiazol-2-ylidene)-2-thioxo-thiazolidin-3-yl]benzoic acid Formula: C18H12N2O3S3 MolecularWeight: 400.49448

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=C3C(=O)N(C(=S)S3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CN\1C2=CC=CC=C2S/C1=C/3\C(=O)N(C(=S)S3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C18H12N2O3S3/c1-19-12-4-2-3-5-13(12)25-16(19)14-15(21)20(18(24)26-14)11-8-6-10(7-9-11)17(22)23/h2-9H,1H3,(H,22,23)/b16-14+