3-[[(5E)-5-[(4-bromophenyl)methylidene]-4-oxidanidyl-1,3-thiazol-2-ylidene]amino]benzoate

Systemtic Name: 3-[[(5E)-5-[(4-bromophenyl)methylidene]-4-oxidanidyl-1,3-thiazol-2-ylidene]amino]benzoate Openeye Name: 3-[[(5E)-5-[(4-bromophenyl)methylene]-4-oxido-thiazol-2-ylidene]amino]benzoate CAS Name: 3-[[(5E)-5-[(4-bromophenyl)methylidene]-4-oxido-2-thiazolylidene]amino]benzoate IUPAC Name: 3-[[(5E)-5-[(4-bromophenyl)methylidene]-4-oxido-1,3-thiazol-2-ylidene]amino]benzoate Traditional Name: 3-[[(5E)-5-(4-bromobenzylidene)-4-oxido-3-thiazolin-2-ylidene]amino]benzoate Formula: C17H9BrN2O3S-2 MolecularWeight: 401.23396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N=C2N=C(C(=CC3=CC=C(C=C3)Br)S2)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)N=C2N=C(/C(=C\C3=CC=C(C=C3)Br)/S2)[O-])C(=O)[O-]

InChI

InChI=1S/C17H11BrN2O3S/c18-12-6-4-10(5-7-12)8-14-15(21)20-17(24-14)19-13-3-1-2-11(9-13)16(22)23/h1-9H,(H,22,23)(H,19,20,21)/p-2/b14-8+