3-[[3-[(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]methyl]benzoic acid

Systemtic Name: 3-[[3-[(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]methyl]benzoic acid Openeye Name: 3-[[3-[(3-ethyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]indol-1-yl]methyl]benzoic acid CAS Name: 3-[[3-[(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-1-indolyl]methyl]benzoic acid IUPAC Name: 3-[[3-[(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]indol-1-yl]methyl]benzoic acid Traditional Name: 3-[[3-[(3-ethyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]indol-1-yl]methyl]benzoic acid Formula: C22H18N2O3S2 MolecularWeight: 422.51992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=CC(=C4)C(=O)O)SC1=S

Isomeric SMILES

CCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=CC=CC(=C4)C(=O)O)SC1=S

InChI

InChI=1S/C22H18N2O3S2/c1-2-24-20(25)19(29-22(24)28)11-16-13-23(18-9-4-3-8-17(16)18)12-14-6-5-7-15(10-14)21(26)27/h3-11,13H,2,12H2,1H3,(H,26,27)