3-methyl-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]butanamide Openeye Name: 3-methyl-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]butanamide CAS Name: 3-methyl-N-[sulfanylidene-[2-(trifluoromethyl)anilino]methyl]butanamide IUPAC Name: 3-methyl-N-[[2-(trifluoromethyl)phenyl]carbamothioyl]butanamide Traditional Name: 3-methyl-N-[[2-(trifluoromethyl)phenyl]thiocarbamoyl]butyramide Formula: C13H15F3N2OS MolecularWeight: 304.33121

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC=CC=C1C(F)(F)F

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC=CC=C1C(F)(F)F

InChI

InChI=1S/C13H15F3N2OS/c1-8(2)7-11(19)18-12(20)17-10-6-4-3-5-9(10)13(14,15)16/h3-6,8H,7H2,1-2H3,(H2,17,18,19,20)