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

Systemtic Name: N-[[2-chloranyl-4-(trifluoromethyl)phenyl]carbamothioyl]butanamide Openeye Name: N-[[2-chloro-4-(trifluoromethyl)phenyl]carbamothioyl]butanamide CAS Name: N-[[2-chloro-4-(trifluoromethyl)anilino]-sulfanylidenemethyl]butanamide IUPAC Name: N-[[2-chloro-4-(trifluoromethyl)phenyl]carbamothioyl]butanamide Traditional Name: N-[[2-chloro-4-(trifluoromethyl)phenyl]thiocarbamoyl]butyramide Formula: C12H12ClF3N2OS MolecularWeight: 324.74969

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12ClF3N2OS/c1-2-3-10(19)18-11(20)17-9-5-4-7(6-8(9)13)12(14,15)16/h4-6H,2-3H2,1H3,(H2,17,18,19,20)