4-[3-[4-oxidanylidene-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]propanoylamino]benzoic acid

Systemtic Name: 4-[3-[4-oxidanylidene-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]propanoylamino]benzoic acid Openeye Name: 4-[3-[4-oxo-5-(2-thienylmethylene)-2-thioxo-thiazolidin-3-yl]propanoylamino]benzoic acid CAS Name: 4-[[1-oxo-3-[4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-3-thiazolidinyl]propyl]amino]benzoic acid IUPAC Name: 4-[3-[4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]propanoylamino]benzoic acid Traditional Name: 4-[3-[4-keto-5-(2-thenylidene)-2-thioxo-thiazolidin-3-yl]propanoylamino]benzoic acid Formula: C18H14N2O4S3 MolecularWeight: 418.50976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CSC(=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H14N2O4S3/c21-15(19-12-5-3-11(4-6-12)17(23)24)7-8-20-16(22)14(27-18(20)25)10-13-2-1-9-26-13/h1-6,9-10H,7-8H2,(H,19,21)(H,23,24)