4-[4-oxidanylidene-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid

Systemtic Name: 4-[4-oxidanylidene-5-[[1-(phenylmethyl)indol-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid Openeye Name: 4-[5-[(1-benzylindol-3-yl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]benzoic acid CAS Name: 4-[4-oxo-5-[[1-(phenylmethyl)-3-indolyl]methylidene]-2-sulfanylidene-3-thiazolidinyl]benzoic acid IUPAC Name: 4-[5-[(1-benzylindol-3-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzoic acid Traditional Name: 4-[5-[(1-benzylindol-3-yl)methylene]-4-keto-2-thioxo-thiazolidin-3-yl]benzoic acid Formula: C26H18N2O3S2 MolecularWeight: 470.56272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C=C4C(=O)N(C(=S)S4)C5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C=C4C(=O)N(C(=S)S4)C5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C26H18N2O3S2/c29-24-23(33-26(32)28(24)20-12-10-18(11-13-20)25(30)31)14-19-16-27(15-17-6-2-1-3-7-17)22-9-5-4-8-21(19)22/h1-14,16H,15H2,(H,30,31)