4-methyl-4-phenyl-3-sulfanylidene-2-[3-(trifluoromethyl)phenyl]pentanenitrile

Systemtic Name: 4-methyl-4-phenyl-3-sulfanylidene-2-[3-(trifluoromethyl)phenyl]pentanenitrile Openeye Name: 4-methyl-4-phenyl-3-thioxo-2-[3-(trifluoromethyl)phenyl]pentanenitrile CAS Name: 4-methyl-4-phenyl-3-sulfanylidene-2-[3-(trifluoromethyl)phenyl]pentanenitrile IUPAC Name: 4-methyl-4-phenyl-3-sulfanylidene-2-[3-(trifluoromethyl)phenyl]pentanenitrile Traditional Name: 4-methyl-4-phenyl-3-thioxo-2-[3-(trifluoromethyl)phenyl]valeronitrile Formula: C19H16F3NS MolecularWeight: 347.39725

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(=S)C(C#N)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(=S)C(C#N)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C19H16F3NS/c1-18(2,14-8-4-3-5-9-14)17(24)16(12-23)13-7-6-10-15(11-13)19(20,21)22/h3-11,16H,1-2H3