(2S)-2-[(5E)-4-oxidanylidene-5-(pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate

Systemtic Name: (2S)-2-[(5E)-4-oxidanylidene-5-(pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Openeye Name: (2S)-2-[(5E)-4-oxo-5-(3-pyridylmethylene)-2-thioxo-thiazolidin-3-yl]hexanoate CAS Name: (2S)-2-[(5E)-4-oxo-5-(3-pyridinylmethylidene)-2-sulfanylidene-3-thiazolidinyl]hexanoate IUPAC Name: (2S)-2-[(5E)-4-oxo-5-(pyridin-3-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Traditional Name: (2S)-2-[(5E)-4-keto-5-(3-pyridylmethylene)-2-thioxo-thiazolidin-3-yl]hexanoate Formula: C15H15N2O3S2- MolecularWeight: 335.4212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)[O-])N1C(=O)C(=CC2=CN=CC=C2)SC1=S

Isomeric SMILES

CCCC[C@@H](C(=O)[O-])N1C(=O)/C(=C\C2=CN=CC=C2)/SC1=S

InChI

InChI=1S/C15H16N2O3S2/c1-2-3-6-11(14(19)20)17-13(18)12(22-15(17)21)8-10-5-4-7-16-9-10/h4-5,7-9,11H,2-3,6H2,1H3,(H,19,20)/p-1/b12-8+/t11-/m0/s1