1-methyl-2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfanyl-imidazole

Systemtic Name: 1-methyl-2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfanyl-imidazole Openeye Name: 1-methyl-2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfanyl-imidazole CAS Name: 1-methyl-2-[[2-nitro-4-(trifluoromethylsulfonyl)phenyl]thio]imidazole IUPAC Name: 1-methyl-2-[2-nitro-4-(trifluoromethylsulfonyl)phenyl]sulfanylimidazole Traditional Name: 1-methyl-2-[(2-nitro-4-triflyl-phenyl)thio]imidazole Formula: C11H8F3N3O4S2 MolecularWeight: 367.32413

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1SC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C11H8F3N3O4S2/c1-16-5-4-15-10(16)22-9-3-2-7(6-8(9)17(18)19)23(20,21)11(12,13)14/h2-6H,1H3