2-[(3-bromanyl-5-nitro-2-oxidanyl-phenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one

Systemtic Name: 2-[(3-bromanyl-5-nitro-2-oxidanyl-phenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one Openeye Name: 2-[(3-bromo-2-hydroxy-5-nitro-phenyl)methylene]thiazolo[3,2-a]benzimidazol-1-one CAS Name: 2-[(3-bromo-2-hydroxy-5-nitrophenyl)methylidene]-1-thiazolo[3,2-a]benzimidazolone IUPAC Name: 2-[(3-bromo-2-hydroxy-5-nitrophenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one Traditional Name: 2-(3-bromo-2-hydroxy-5-nitro-benzylidene)thiazolo[3,2-a]benzimidazol-1-one Formula: C16H8BrN3O4S MolecularWeight: 418.22142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C3N2C(=O)C(=CC4=CC(=CC(=C4O)Br)[N+](=O)[O-])S3

Isomeric SMILES

C1=CC=C2C(=C1)N=C3N2C(=O)C(=CC4=CC(=CC(=C4O)Br)[N+](=O)[O-])S3

InChI

InChI=1S/C16H8BrN3O4S/c17-10-7-9(20(23)24)5-8(14(10)21)6-13-15(22)19-12-4-2-1-3-11(12)18-16(19)25-13/h1-7,21H