4-[[(5Z)-5-[(5-bromanyl-2-prop-2-ynoxy-phenyl)methylidene]-3-methyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid

Systemtic Name: 4-[[(5Z)-5-[(5-bromanyl-2-prop-2-ynoxy-phenyl)methylidene]-3-methyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid Openeye Name: 4-[[(5Z)-5-[(5-bromo-2-prop-2-ynoxy-phenyl)methylene]-3-methyl-4-oxo-thiazolidin-2-ylidene]amino]benzoic acid CAS Name: 4-[[(5Z)-5-[(5-bromo-2-prop-2-ynoxyphenyl)methylidene]-3-methyl-4-oxo-2-thiazolidinylidene]amino]benzoic acid IUPAC Name: 4-[[(5Z)-5-[(5-bromo-2-prop-2-ynoxyphenyl)methylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid Traditional Name: 4-[[(5Z)-5-(5-bromo-2-propargyloxy-benzylidene)-4-keto-3-methyl-thiazolidin-2-ylidene]amino]benzoic acid Formula: C21H15BrN2O4S MolecularWeight: 471.3238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=C(C=CC(=C2)Br)OCC#C)SC1=NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN1C(=O)/C(=C/C2=C(C=CC(=C2)Br)OCC#C)/SC1=NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H15BrN2O4S/c1-3-10-28-17-9-6-15(22)11-14(17)12-18-19(25)24(2)21(29-18)23-16-7-4-13(5-8-16)20(26)27/h1,4-9,11-12H,10H2,2H3,(H,26,27)/b18-12-,23-21?