(2E)-2-[(3-iodanyl-5-nitro-4-oxidanyl-phenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one

Systemtic Name: (2E)-2-[(3-iodanyl-5-nitro-4-oxidanyl-phenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one Openeye Name: (2E)-2-[(4-hydroxy-3-iodo-5-nitro-phenyl)methylene]thiazolo[3,2-a]benzimidazol-1-one CAS Name: (2E)-2-[(4-hydroxy-3-iodo-5-nitrophenyl)methylidene]-1-thiazolo[3,2-a]benzimidazolone IUPAC Name: (2E)-2-[(4-hydroxy-3-iodo-5-nitrophenyl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one Traditional Name: (2E)-2-(4-hydroxy-3-iodo-5-nitro-benzylidene)thiazolo[3,2-a]benzimidazol-1-one Formula: C16H8IN3O4S MolecularWeight: 465.22189

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C3N2C(=O)C(=CC4=CC(=C(C(=C4)I)O)[N+](=O)[O-])S3

Isomeric SMILES

C1=CC=C2C(=C1)N=C3N2C(=O)/C(=C\C4=CC(=C(C(=C4)I)O)[N+](=O)[O-])/S3

InChI

InChI=1S/C16H8IN3O4S/c17-9-5-8(6-12(14(9)21)20(23)24)7-13-15(22)19-11-4-2-1-3-10(11)18-16(19)25-13/h1-7,21H/b13-7+