5-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-1,3-dimethyl-6-nitro-benzimidazol-2-one

Systemtic Name: 5-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-1,3-dimethyl-6-nitro-benzimidazol-2-one Openeye Name: 5-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-1,3-dimethyl-6-nitro-benzimidazol-2-one CAS Name: 5-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]-1,3-dimethyl-6-nitro-2-benzimidazolone IUPAC Name: 5-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-1,3-dimethyl-6-nitrobenzimidazol-2-one Traditional Name: 5-[4-(4-fluorophenyl)sulfonylpiperazino]-1,3-dimethyl-6-nitro-benzimidazol-2-one Formula: C19H20FN5O5S MolecularWeight: 449.456003

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2N(C1=O)C)[N+](=O)[O-])N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CN1C2=CC(=C(C=C2N(C1=O)C)[N+](=O)[O-])N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C19H20FN5O5S/c1-21-15-11-17(18(25(27)28)12-16(15)22(2)19(21)26)23-7-9-24(10-8-23)31(29,30)14-5-3-13(20)4-6-14/h3-6,11-12H,7-10H2,1-2H3