2-methyl-2-[(5E)-5-[(1-methylbenzimidazol-2-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

Systemtic Name: 2-methyl-2-[(5E)-5-[(1-methylbenzimidazol-2-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Openeye Name: 2-methyl-2-[(5E)-5-[(1-methylbenzimidazol-2-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoic acid CAS Name: 2-methyl-2-[(5E)-5-[(1-methyl-2-benzimidazolyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid IUPAC Name: 2-methyl-2-[(5E)-5-[(1-methylbenzimidazol-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid Traditional Name: 2-[(5E)-4-keto-5-[(1-methylbenzimidazol-2-yl)methylene]-2-thioxo-thiazolidin-3-yl]-2-methyl-propionic acid Formula: C16H15N3O3S2 MolecularWeight: 361.4386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)N1C(=O)C(=CC2=NC3=CC=CC=C3N2C)SC1=S

Isomeric SMILES

CC(C)(C(=O)O)N1C(=O)/C(=C\C2=NC3=CC=CC=C3N2C)/SC1=S

InChI

InChI=1S/C16H15N3O3S2/c1-16(2,14(21)22)19-13(20)11(24-15(19)23)8-12-17-9-6-4-5-7-10(9)18(12)3/h4-8H,1-3H3,(H,21,22)/b11-8+