6-[4-oxidanylidene-5-(quinolin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid

Systemtic Name: 6-[4-oxidanylidene-5-(quinolin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Openeye Name: 6-[4-oxo-5-(4-quinolylmethylene)-2-thioxo-thiazolidin-3-yl]hexanoic acid CAS Name: 6-[4-oxo-5-(4-quinolinylmethylidene)-2-sulfanylidene-3-thiazolidinyl]hexanoic acid IUPAC Name: 6-[4-oxo-5-(quinolin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Traditional Name: 6-[4-keto-5-(4-quinolylmethylene)-2-thioxo-thiazolidin-3-yl]hexanoic acid Formula: C19H18N2O3S2 MolecularWeight: 386.48782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)C=C3C(=O)N(C(=S)S3)CCCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)C=C3C(=O)N(C(=S)S3)CCCCCC(=O)O

InChI

InChI=1S/C19H18N2O3S2/c22-17(23)8-2-1-5-11-21-18(24)16(26-19(21)25)12-13-9-10-20-15-7-4-3-6-14(13)15/h3-4,6-7,9-10,12H,1-2,5,8,11H2,(H,22,23)