(5E)-5-[(5-bromanyl-3-nitro-2-oxidanyl-phenyl)methylidene]-2-phenylazanyl-1,3-thiazol-4-one

Systemtic Name: (5E)-5-[(5-bromanyl-3-nitro-2-oxidanyl-phenyl)methylidene]-2-phenylazanyl-1,3-thiazol-4-one Openeye Name: (5E)-2-anilino-5-[(5-bromo-2-hydroxy-3-nitro-phenyl)methylene]thiazol-4-one CAS Name: (5E)-2-anilino-5-[(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-4-thiazolone IUPAC Name: (5E)-2-anilino-5-[(5-bromo-2-hydroxy-3-nitrophenyl)methylidene]-1,3-thiazol-4-one Traditional Name: (5E)-2-anilino-5-(5-bromo-2-hydroxy-3-nitro-benzylidene)-2-thiazolin-4-one Formula: C16H10BrN3O4S MolecularWeight: 420.2373

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=O)C(=CC3=CC(=CC(=C3O)[N+](=O)[O-])Br)S2

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=O)/C(=C\C3=CC(=CC(=C3O)[N+](=O)[O-])Br)/S2

InChI

InChI=1S/C16H10BrN3O4S/c17-10-6-9(14(21)12(8-10)20(23)24)7-13-15(22)19-16(25-13)18-11-4-2-1-3-5-11/h1-8,21H,(H,18,19,22)/b13-7+