2-[4-[(5E)-4-oxidanylidene-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(5E)-4-oxidanylidene-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]phenyl]ethanoic acid Openeye Name: 2-[4-[(5E)-4-oxo-5-(4-pyridylmethylene)-2-thioxo-thiazolidin-3-yl]phenyl]acetic acid CAS Name: 2-[4-[(5E)-4-oxo-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-3-thiazolidinyl]phenyl]acetic acid IUPAC Name: 2-[4-[(5E)-4-oxo-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]phenyl]acetic acid Traditional Name: 2-[4-[(5E)-4-keto-5-(4-pyridylmethylene)-2-thioxo-thiazolidin-3-yl]phenyl]acetic acid Formula: C17H12N2O3S2 MolecularWeight: 356.41878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)N2C(=O)C(=CC3=CC=NC=C3)SC2=S

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)N2C(=O)/C(=C\C3=CC=NC=C3)/SC2=S

InChI

InChI=1S/C17H12N2O3S2/c20-15(21)10-11-1-3-13(4-2-11)19-16(22)14(24-17(19)23)9-12-5-7-18-8-6-12/h1-9H,10H2,(H,20,21)/b14-9+