2-(1H-imidazol-2-yl)-4-methyl-4-[4-[2-methyl-4-(trifluoromethyl)phenyl]sulfanylphenoxy]-3-oxidanylidene-pentanenitrile

Systemtic Name: 2-(1H-imidazol-2-yl)-4-methyl-4-[4-[2-methyl-4-(trifluoromethyl)phenyl]sulfanylphenoxy]-3-oxidanylidene-pentanenitrile Openeye Name: 2-(1H-imidazol-2-yl)-4-methyl-4-[4-[2-methyl-4-(trifluoromethyl)phenyl]sulfanylphenoxy]-3-oxo-pentanenitrile CAS Name: 2-(1H-imidazol-2-yl)-4-methyl-4-[4-[[2-methyl-4-(trifluoromethyl)phenyl]thio]phenoxy]-3-oxopentanenitrile IUPAC Name: 2-(1H-imidazol-2-yl)-4-methyl-4-[4-[2-methyl-4-(trifluoromethyl)phenyl]sulfanylphenoxy]-3-oxopentanenitrile Traditional Name: 2-(1H-imidazol-2-yl)-3-keto-4-methyl-4-[4-[[2-methyl-4-(trifluoromethyl)phenyl]thio]phenoxy]valeronitrile Formula: C23H20F3N3O2S MolecularWeight: 459.48401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(F)(F)F)SC2=CC=C(C=C2)OC(C)(C)C(=O)C(C#N)C3=NC=CN3

Isomeric SMILES

CC1=C(C=CC(=C1)C(F)(F)F)SC2=CC=C(C=C2)OC(C)(C)C(=O)C(C#N)C3=NC=CN3

InChI

InChI=1S/C23H20F3N3O2S/c1-14-12-15(23(24,25)26)4-9-19(14)32-17-7-5-16(6-8-17)31-22(2,3)20(30)18(13-27)21-28-10-11-29-21/h4-12,18H,1-3H3,(H,28,29)