4-[4,4-dimethyl-5-oxidanylidene-2-(3-oxidanylpropylsulfanyl)imidazol-1-yl]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[4,4-dimethyl-5-oxidanylidene-2-(3-oxidanylpropylsulfanyl)imidazol-1-yl]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[2-(3-hydroxypropylsulfanyl)-4,4-dimethyl-5-oxo-imidazol-1-yl]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[2-(3-hydroxypropylthio)-4,4-dimethyl-5-oxo-1-imidazolyl]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[2-(3-hydroxypropylsulfanyl)-4,4-dimethyl-5-oxoimidazol-1-yl]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[2-(3-hydroxypropylthio)-5-keto-4,4-dimethyl-2-imidazolin-1-yl]-2-(trifluoromethyl)benzonitrile Formula: C16H16F3N3O2S MolecularWeight: 371.37735

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=N1)SCCCO)C2=CC(=C(C=C2)C#N)C(F)(F)F)C

Isomeric SMILES

CC1(C(=O)N(C(=N1)SCCCO)C2=CC(=C(C=C2)C#N)C(F)(F)F)C

InChI

InChI=1S/C16H16F3N3O2S/c1-15(2)13(24)22(14(21-15)25-7-3-6-23)11-5-4-10(9-20)12(8-11)16(17,18)19/h4-5,8,23H,3,6-7H2,1-2H3