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

Systemtic Name: 3-[[(5E)-5-[(4-bromophenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoate Openeye Name: 3-[[(5E)-5-[(4-bromophenyl)methylene]-4-oxo-thiazol-2-yl]amino]benzoate CAS Name: 3-[[(5E)-5-[(4-bromophenyl)methylidene]-4-oxo-2-thiazolyl]amino]benzoate IUPAC Name: 3-[[(5E)-5-[(4-bromophenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]amino]benzoate Traditional Name: 3-[[(5E)-5-(4-bromobenzylidene)-4-keto-2-thiazolin-2-yl]amino]benzoate Formula: C17H10BrN2O3S- MolecularWeight: 402.2419

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC(=O)C(=CC3=CC=C(C=C3)Br)S2)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC(=O)/C(=C\C3=CC=C(C=C3)Br)/S2)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-1/b14-8+