4-[5-azanylidene-4,4-dimethyl-3-(4-oxidanylbutyl)-2-sulfanylidene-imidazolidin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[5-azanylidene-4,4-dimethyl-3-(4-oxidanylbutyl)-2-sulfanylidene-imidazolidin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[3-(4-hydroxybutyl)-5-imino-4,4-dimethyl-2-thioxo-imidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[3-(4-hydroxybutyl)-5-imino-4,4-dimethyl-2-sulfanylidene-1-imidazolidinyl]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[3-(4-hydroxybutyl)-5-imino-4,4-dimethyl-2-sulfanylideneimidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[3-(4-hydroxybutyl)-5-imino-4,4-dimethyl-2-thioxo-imidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile Formula: C17H19F3N4OS MolecularWeight: 384.41917

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=N)N(C(=S)N1CCCCO)C2=CC(=C(C=C2)C#N)C(F)(F)F)C

Isomeric SMILES

CC1(C(=N)N(C(=S)N1CCCCO)C2=CC(=C(C=C2)C#N)C(F)(F)F)C

InChI

InChI=1S/C17H19F3N4OS/c1-16(2)14(22)24(15(26)23(16)7-3-4-8-25)12-6-5-11(10-21)13(9-12)17(18,19)20/h5-6,9,22,25H,3-4,7-8H2,1-2H3