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

Systemtic Name: 4-[4,4-dimethyl-5-oxidanylidene-3-(8-pyrrolidin-1-yloctyl)-2-sulfanylidene-imidazolidin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[4,4-dimethyl-5-oxo-3-(8-pyrrolidin-1-yloctyl)-2-thioxo-imidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[4,4-dimethyl-5-oxo-3-[8-(1-pyrrolidinyl)octyl]-2-sulfanylidene-1-imidazolidinyl]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[4,4-dimethyl-5-oxo-3-(8-pyrrolidin-1-yloctyl)-2-sulfanylideneimidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[5-keto-4,4-dimethyl-3-(8-pyrrolidinooctyl)-2-thioxo-imidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile Formula: C25H33F3N4OS MolecularWeight: 494.61593

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=S)N1CCCCCCCCN2CCCC2)C3=CC(=C(C=C3)C#N)C(F)(F)F)C

Isomeric SMILES

CC1(C(=O)N(C(=S)N1CCCCCCCCN2CCCC2)C3=CC(=C(C=C3)C#N)C(F)(F)F)C

InChI

InChI=1S/C25H33F3N4OS/c1-24(2)22(33)32(20-12-11-19(18-29)21(17-20)25(26,27)28)23(34)31(24)16-8-6-4-3-5-7-13-30-14-9-10-15-30/h11-12,17H,3-10,13-16H2,1-2H3