3-[5,5-dimethyl-3-[4-nitro-3-(trifluoromethyl)phenyl]-4-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]propane-1-sulfonamide

Systemtic Name: 3-[5,5-dimethyl-3-[4-nitro-3-(trifluoromethyl)phenyl]-4-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]propane-1-sulfonamide Openeye Name: 3-[5,5-dimethyl-3-[4-nitro-3-(trifluoromethyl)phenyl]-4-oxo-2-thioxo-imidazolidin-1-yl]propane-1-sulfonamide CAS Name: 3-[5,5-dimethyl-3-[4-nitro-3-(trifluoromethyl)phenyl]-4-oxo-2-sulfanylidene-1-imidazolidinyl]-1-propanesulfonamide IUPAC Name: 3-[5,5-dimethyl-3-[4-nitro-3-(trifluoromethyl)phenyl]-4-oxo-2-sulfanylideneimidazolidin-1-yl]propane-1-sulfonamide Traditional Name: 3-[4-keto-5,5-dimethyl-3-[4-nitro-3-(trifluoromethyl)phenyl]-2-thioxo-imidazolidin-1-yl]propane-1-sulfonamide Formula: C15H17F3N4O5S2 MolecularWeight: 454.44449

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=S)N1CCCS(=O)(=O)N)C2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)C

Isomeric SMILES

CC1(C(=O)N(C(=S)N1CCCS(=O)(=O)N)C2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)C

InChI

InChI=1S/C15H17F3N4O5S2/c1-14(2)12(23)21(13(28)20(14)6-3-7-29(19,26)27)9-4-5-11(22(24)25)10(8-9)15(16,17)18/h4-5,8H,3,6-7H2,1-2H3,(H2,19,26,27)