2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanyl-N-(1-cyanocyclohexyl)propanamide

Systemtic Name: 2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanyl-N-(1-cyanocyclohexyl)propanamide Openeye Name: 2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanyl-N-(1-cyanocyclohexyl)propanamide CAS Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]-N-(1-cyanocyclohexyl)propanamide IUPAC Name: 2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanyl-N-(1-cyanocyclohexyl)propanamide Traditional Name: 2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]-N-(1-cyanocyclohexyl)propionamide Formula: C17H18ClF3N2OS MolecularWeight: 390.85083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)SC2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CC(C(=O)NC1(CCCCC1)C#N)SC2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C17H18ClF3N2OS/c1-11(15(24)23-16(10-22)7-3-2-4-8-16)25-12-5-6-14(18)13(9-12)17(19,20)21/h5-6,9,11H,2-4,7-8H2,1H3,(H,23,24)