(2R)-2-[(5E)-4-oxidanylidene-5-(quinolin-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenyl-ethanoate

Systemtic Name: (2R)-2-[(5E)-4-oxidanylidene-5-(quinolin-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenyl-ethanoate Openeye Name: (2R)-2-[(5E)-4-oxo-5-(2-quinolylmethylene)-2-thioxo-thiazolidin-3-yl]-2-phenyl-acetate CAS Name: (2R)-2-[(5E)-4-oxo-5-(2-quinolinylmethylidene)-2-sulfanylidene-3-thiazolidinyl]-2-phenylacetate IUPAC Name: (2R)-2-[(5E)-4-oxo-5-(quinolin-2-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetate Traditional Name: (2R)-2-[(5E)-4-keto-5-(2-quinolylmethylene)-2-thioxo-thiazolidin-3-yl]-2-phenyl-acetate Formula: C21H13N2O3S2- MolecularWeight: 405.46952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)[O-])N2C(=O)C(=CC3=NC4=CC=CC=C4C=C3)SC2=S

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C(=O)[O-])N2C(=O)/C(=C\C3=NC4=CC=CC=C4C=C3)/SC2=S

InChI

InChI=1S/C21H14N2O3S2/c24-19-17(12-15-11-10-13-6-4-5-9-16(13)22-15)28-21(27)23(19)18(20(25)26)14-7-2-1-3-8-14/h1-12,18H,(H,25,26)/p-1/b17-12+/t18-/m1/s1