S3,S5-dimethyl 2-[bis(fluoranyl)methyl]-4-(2-methylpropyl)-6-(trifluoromethyl)pyridine-3,5-dicarbothioate

Systemtic Name: S3,S5-dimethyl 2-[bis(fluoranyl)methyl]-4-(2-methylpropyl)-6-(trifluoromethyl)pyridine-3,5-dicarbothioate Openeye Name: S3,S5-dimethyl 2-(difluoromethyl)-4-isobutyl-6-(trifluoromethyl)pyridine-3,5-dicarbothioate CAS Name: 2-(difluoromethyl)-4-(2-methylpropyl)-6-(trifluoromethyl)pyridine-3,5-dicarbothioic acid S3,S5-dimethyl ester IUPAC Name: 3-S,5-S-dimethyl 2-(difluoromethyl)-4-(2-methylpropyl)-6-(trifluoromethyl)pyridine-3,5-dicarbothioate Traditional Name: 2-(difluoromethyl)-4-isobutyl-6-(trifluoromethyl)pyridine-3,5-dicarbothioic acid S3,S5-dimethyl ester Formula: C15H16F5NO2S2 MolecularWeight: 401.415056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C(=NC(=C1C(=O)SC)C(F)(F)F)C(F)F)C(=O)SC

Isomeric SMILES

CC(C)CC1=C(C(=NC(=C1C(=O)SC)C(F)(F)F)C(F)F)C(=O)SC

InChI

InChI=1S/C15H16F5NO2S2/c1-6(2)5-7-8(13(22)24-3)10(12(16)17)21-11(15(18,19)20)9(7)14(23)25-4/h6,12H,5H2,1-4H3