(2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-methylsulfanyl-butanoic acid

Systemtic Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-methylsulfanyl-butanoic acid Openeye Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]-4-methylsulfanyl-butanoic acid CAS Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-4-(methylthio)butanoic acid IUPAC Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-methylsulfanylbutanoic acid Traditional Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylene)-4-keto-2-thioxo-thiazolidin-3-yl]-4-(methylthio)butyric acid Formula: C16H15N3O3S3 MolecularWeight: 393.5036

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)N1C(=O)C(=CC2=NC3=CC=CC=C3N2)SC1=S

Isomeric SMILES

CSCC[C@H](C(=O)O)N1C(=O)/C(=C\C2=NC3=CC=CC=C3N2)/SC1=S

InChI

InChI=1S/C16H15N3O3S3/c1-24-7-6-11(15(21)22)19-14(20)12(25-16(19)23)8-13-17-9-4-2-3-5-10(9)18-13/h2-5,8,11H,6-7H2,1H3,(H,17,18)(H,21,22)/b12-8+/t11-/m1/s1