4-[3-(8-iodanyloctyl)-4,4-dimethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[3-(8-iodanyloctyl)-4,4-dimethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[3-(8-iodooctyl)-4,4-dimethyl-5-oxo-2-thioxo-imidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[3-(8-iodooctyl)-4,4-dimethyl-5-oxo-2-sulfanylidene-1-imidazolidinyl]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[3-(8-iodooctyl)-4,4-dimethyl-5-oxo-2-sulfanylideneimidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[3-(8-iodooctyl)-5-keto-4,4-dimethyl-2-thioxo-imidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile Formula: C21H25F3IN3OS MolecularWeight: 551.40738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=S)N1CCCCCCCCI)C2=CC(=C(C=C2)C#N)C(F)(F)F)C

Isomeric SMILES

CC1(C(=O)N(C(=S)N1CCCCCCCCI)C2=CC(=C(C=C2)C#N)C(F)(F)F)C

InChI

InChI=1S/C21H25F3IN3OS/c1-20(2)18(29)28(16-10-9-15(14-26)17(13-16)21(22,23)24)19(30)27(20)12-8-6-4-3-5-7-11-25/h9-10,13H,3-8,11-12H2,1-2H3