4-[3-(9-iodanylnonyl)-4,4-dimethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[3-(9-iodanylnonyl)-4,4-dimethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[3-(9-iodononyl)-4,4-dimethyl-5-oxo-2-thioxo-imidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[3-(9-iodononyl)-4,4-dimethyl-5-oxo-2-sulfanylidene-1-imidazolidinyl]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[3-(9-iodononyl)-4,4-dimethyl-5-oxo-2-sulfanylideneimidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[3-(9-iodononyl)-5-keto-4,4-dimethyl-2-thioxo-imidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile Formula: C22H27F3IN3OS MolecularWeight: 565.43396

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=S)N1CCCCCCCCCI)C2=CC(=C(C=C2)C#N)C(F)(F)F)C

Isomeric SMILES

CC1(C(=O)N(C(=S)N1CCCCCCCCCI)C2=CC(=C(C=C2)C#N)C(F)(F)F)C

InChI

InChI=1S/C22H27F3IN3OS/c1-21(2)19(30)29(17-11-10-16(15-27)18(14-17)22(23,24)25)20(31)28(21)13-9-7-5-3-4-6-8-12-26/h10-11,14H,3-9,12-13H2,1-2H3