4-[(4-fluorophenyl)sulfonylmethyl]-1,2-dimethyl-5-nitro-imidazole

Systemtic Name: 4-[(4-fluorophenyl)sulfonylmethyl]-1,2-dimethyl-5-nitro-imidazole Openeye Name: 4-[(4-fluorophenyl)sulfonylmethyl]-1,2-dimethyl-5-nitro-imidazole CAS Name: 4-[(4-fluorophenyl)sulfonylmethyl]-1,2-dimethyl-5-nitroimidazole IUPAC Name: 4-[(4-fluorophenyl)sulfonylmethyl]-1,2-dimethyl-5-nitroimidazole Traditional Name: 4-[(4-fluorophenyl)sulfonylmethyl]-1,2-dimethyl-5-nitro-imidazole Formula: C12H12FN3O4S MolecularWeight: 313.304783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(N1C)[N+](=O)[O-])CS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC1=NC(=C(N1C)[N+](=O)[O-])CS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C12H12FN3O4S/c1-8-14-11(12(15(8)2)16(17)18)7-21(19,20)10-5-3-9(13)4-6-10/h3-6H,7H2,1-2H3