2-(2-chloranyl-6-nitro-phenyl)sulfanyl-1-nitro-imidazole

Systemtic Name: 2-(2-chloranyl-6-nitro-phenyl)sulfanyl-1-nitro-imidazole Openeye Name: 2-(2-chloro-6-nitro-phenyl)sulfanyl-1-nitro-imidazole CAS Name: 2-[(2-chloro-6-nitrophenyl)thio]-1-nitroimidazole IUPAC Name: 2-(2-chloro-6-nitrophenyl)sulfanyl-1-nitroimidazole Traditional Name: 2-[(2-chloro-6-nitro-phenyl)thio]-1-nitro-imidazole Formula: C9H5ClN4O4S MolecularWeight: 300.6784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)SC2=NC=CN2[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)SC2=NC=CN2[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H5ClN4O4S/c10-6-2-1-3-7(13(15)16)8(6)19-9-11-4-5-12(9)14(17)18/h1-5H