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

Systemtic Name: 4-[4,4-dimethyl-5-oxidanylidene-3-(9-pyrrolidin-1-ylnonyl)-2-sulfanylidene-imidazolidin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[4,4-dimethyl-5-oxo-3-(9-pyrrolidin-1-ylnonyl)-2-thioxo-imidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[4,4-dimethyl-5-oxo-3-[9-(1-pyrrolidinyl)nonyl]-2-sulfanylidene-1-imidazolidinyl]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[4,4-dimethyl-5-oxo-3-(9-pyrrolidin-1-ylnonyl)-2-sulfanylideneimidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[5-keto-4,4-dimethyl-3-(9-pyrrolidinononyl)-2-thioxo-imidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile Formula: C26H35F3N4OS MolecularWeight: 508.64251

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=S)N1CCCCCCCCCN2CCCC2)C3=CC(=C(C=C3)C#N)C(F)(F)F)C

Isomeric SMILES

CC1(C(=O)N(C(=S)N1CCCCCCCCCN2CCCC2)C3=CC(=C(C=C3)C#N)C(F)(F)F)C

InChI

InChI=1S/C26H35F3N4OS/c1-25(2)23(34)33(21-13-12-20(19-30)22(18-21)26(27,28)29)24(35)32(25)17-9-7-5-3-4-6-8-14-31-15-10-11-16-31/h12-13,18H,3-11,14-17H2,1-2H3