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

Systemtic Name: 4-[[(5E)-5-[(5-bromanyl-2-methoxy-phenyl)methylidene]-4-oxidanidyl-1,3-thiazol-2-ylidene]amino]benzoate Openeye Name: 4-[[(5E)-5-[(5-bromo-2-methoxy-phenyl)methylene]-4-oxido-thiazol-2-ylidene]amino]benzoate CAS Name: 4-[[(5E)-5-[(5-bromo-2-methoxyphenyl)methylidene]-4-oxido-2-thiazolylidene]amino]benzoate IUPAC Name: 4-[[(5E)-5-[(5-bromo-2-methoxyphenyl)methylidene]-4-oxido-1,3-thiazol-2-ylidene]amino]benzoate Traditional Name: 4-[[(5E)-5-(5-bromo-2-methoxy-benzylidene)-4-oxido-3-thiazolin-2-ylidene]amino]benzoate Formula: C18H11BrN2O4S-2 MolecularWeight: 431.25994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=C2C(=NC(=NC3=CC=C(C=C3)C(=O)[O-])S2)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/2\C(=NC(=NC3=CC=C(C=C3)C(=O)[O-])S2)[O-]

InChI

InChI=1S/C18H13BrN2O4S/c1-25-14-7-4-12(19)8-11(14)9-15-16(22)21-18(26-15)20-13-5-2-10(3-6-13)17(23)24/h2-9H,1H3,(H,23,24)(H,20,21,22)/p-2/b15-9+