2-(2,5-dimethylphenyl)sulfanyl-5-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 2-(2,5-dimethylphenyl)sulfanyl-5-(trifluoromethyl)benzenecarbonitrile Openeye Name: 2-(2,5-dimethylphenyl)sulfanyl-5-(trifluoromethyl)benzonitrile CAS Name: 2-[(2,5-dimethylphenyl)thio]-5-(trifluoromethyl)benzonitrile IUPAC Name: 2-(2,5-dimethylphenyl)sulfanyl-5-(trifluoromethyl)benzonitrile Traditional Name: 2-[(2,5-dimethylphenyl)thio]-5-(trifluoromethyl)benzonitrile Formula: C16H12F3NS MolecularWeight: 307.33339

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=C(C=C(C=C2)C(F)(F)F)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=C(C=C(C=C2)C(F)(F)F)C#N

InChI

InChI=1S/C16H12F3NS/c1-10-3-4-11(2)15(7-10)21-14-6-5-13(16(17,18)19)8-12(14)9-20/h3-8H,1-2H3