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

Systemtic Name: 4-[(5E)-5-(3-methyl-3H-1-benzothiophen-2-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid Openeye Name: 4-[(5E)-5-(3-methyl-3H-benzothiophen-2-ylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]benzoic acid CAS Name: 4-[(5E)-5-(3-methyl-3H-1-benzothiophen-2-ylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]benzoic acid IUPAC Name: 4-[(5E)-5-(3-methyl-3H-1-benzothiophen-2-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid Traditional Name: 4-[(5E)-4-keto-5-(3-methyl-3H-benzothiophen-2-ylidene)-2-thioxo-thiazolidin-3-yl]benzoic acid Formula: C19H13NO3S3 MolecularWeight: 399.50642

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2SC1=C3C(=O)N(C(=S)S3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C19H13NO3S3/c1-10-13-4-2-3-5-14(13)25-15(10)16-17(21)20(19(24)26-16)12-8-6-11(7-9-12)18(22)23/h2-10H,1H3,(H,22,23)/b16-15+