ethyl 4-[6-[(5E)-2-oxidanylidene-5-(phenylmethylidene)-4-sulfanylidene-1,3-thiazolidin-3-yl]hexanoylamino]benzoate

Systemtic Name: ethyl 4-[6-[(5E)-2-oxidanylidene-5-(phenylmethylidene)-4-sulfanylidene-1,3-thiazolidin-3-yl]hexanoylamino]benzoate Openeye Name: ethyl 4-[6-[(5E)-5-benzylidene-2-oxo-4-thioxo-thiazolidin-3-yl]hexanoylamino]benzoate CAS Name: 4-[[1-oxo-6-[(5E)-2-oxo-5-(phenylmethylene)-4-sulfanylidene-3-thiazolidinyl]hexyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[6-[(5E)-5-benzylidene-2-oxo-4-sulfanylidene-1,3-thiazolidin-3-yl]hexanoylamino]benzoate Traditional Name: 4-[6-[(5E)-5-benzal-2-keto-4-thioxo-thiazolidin-3-yl]hexanoylamino]benzoic acid ethyl ester Formula: C25H26N2O4S2 MolecularWeight: 482.61494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCCCN2C(=S)C(=CC3=CC=CC=C3)SC2=O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCCCN2C(=S)/C(=C\C3=CC=CC=C3)/SC2=O

InChI

InChI=1S/C25H26N2O4S2/c1-2-31-24(29)19-12-14-20(15-13-19)26-22(28)11-7-4-8-16-27-23(32)21(33-25(27)30)17-18-9-5-3-6-10-18/h3,5-6,9-10,12-15,17H,2,4,7-8,11,16H2,1H3,(H,26,28)/b21-17+