6-[(5E)-5-[(1-methylpyrrol-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid

Systemtic Name: 6-[(5E)-5-[(1-methylpyrrol-3-yl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Openeye Name: 6-[(5E)-5-[(1-methylpyrrol-3-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]hexanoic acid CAS Name: 6-[(5E)-5-[(1-methyl-3-pyrrolyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]hexanoic acid IUPAC Name: 6-[(5E)-5-[(1-methylpyrrol-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Traditional Name: 6-[(5E)-4-keto-5-[(1-methylpyrrol-3-yl)methylene]-2-thioxo-thiazolidin-3-yl]hexanoic acid Formula: C15H18N2O3S2 MolecularWeight: 338.44502

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)C=C2C(=O)N(C(=S)S2)CCCCCC(=O)O

Isomeric SMILES

CN1C=CC(=C1)/C=C/2\C(=O)N(C(=S)S2)CCCCCC(=O)O

InChI

InChI=1S/C15H18N2O3S2/c1-16-8-6-11(10-16)9-12-14(20)17(15(21)22-12)7-4-2-3-5-13(18)19/h6,8-10H,2-5,7H2,1H3,(H,18,19)/b12-9+