4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(2,6-dimethylphenyl)butanamide

Systemtic Name: 4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(2,6-dimethylphenyl)butanamide Openeye Name: 4-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]-N-(2,6-dimethylphenyl)butanamide CAS Name: 4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]-N-(2,6-dimethylphenyl)butanamide IUPAC Name: 4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-(2,6-dimethylphenyl)butanamide Traditional Name: 4-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]-N-(2,6-dimethylphenyl)butyramide Formula: C18H18ClF3N2OS MolecularWeight: 402.86153

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCSC2=C(C=C(C=N2)C(F)(F)F)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCSC2=C(C=C(C=N2)C(F)(F)F)Cl

InChI

InChI=1S/C18H18ClF3N2OS/c1-11-5-3-6-12(2)16(11)24-15(25)7-4-8-26-17-14(19)9-13(10-23-17)18(20,21)22/h3,5-6,9-10H,4,7-8H2,1-2H3,(H,24,25)