N-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamothioyl]hexanamide

Systemtic Name: N-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamothioyl]hexanamide Openeye Name: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]hexanamide CAS Name: N-[[2-chloro-5-(trifluoromethyl)anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl]hexanamide Traditional Name: N-[[2-chloro-5-(trifluoromethyl)phenyl]thiocarbamoyl]hexanamide Formula: C14H16ClF3N2OS MolecularWeight: 352.80285

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=C(C=CC(=C1)C(F)(F)F)Cl

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=C(C=CC(=C1)C(F)(F)F)Cl

InChI

InChI=1S/C14H16ClF3N2OS/c1-2-3-4-5-12(21)20-13(22)19-11-8-9(14(16,17)18)6-7-10(11)15/h6-8H,2-5H2,1H3,(H2,19,20,21,22)