N-[[2-chloranyl-4-(trifluoromethyl)phenyl]carbamothioyl]pentanamide

Systemtic Name: N-[[2-chloranyl-4-(trifluoromethyl)phenyl]carbamothioyl]pentanamide Openeye Name: N-[[2-chloro-4-(trifluoromethyl)phenyl]carbamothioyl]pentanamide CAS Name: N-[[2-chloro-4-(trifluoromethyl)anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[2-chloro-4-(trifluoromethyl)phenyl]carbamothioyl]pentanamide Traditional Name: N-[[2-chloro-4-(trifluoromethyl)phenyl]thiocarbamoyl]valeramide Formula: C13H14ClF3N2OS MolecularWeight: 338.77627

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=C(C=C(C=C1)C(F)(F)F)Cl

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=C(C=C(C=C1)C(F)(F)F)Cl

InChI

InChI=1S/C13H14ClF3N2OS/c1-2-3-4-11(20)19-12(21)18-10-6-5-8(7-9(10)14)13(15,16)17/h5-7H,2-4H2,1H3,(H2,18,19,20,21)