N-aminocarbonyl-2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanyl-3-methyl-butanamide

Systemtic Name: N-aminocarbonyl-2-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfanyl-3-methyl-butanamide Openeye Name: N-carbamoyl-2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanyl-3-methyl-butanamide CAS Name: N-carbamoyl-2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]-3-methylbutanamide IUPAC Name: N-carbamoyl-2-[4-chloro-3-(trifluoromethyl)phenyl]sulfanyl-3-methylbutanamide Traditional Name: N-carbamoyl-2-[[4-chloro-3-(trifluoromethyl)phenyl]thio]-3-methyl-butyramide Formula: C13H14ClF3N2O2S MolecularWeight: 354.77567

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)SC1=CC(=C(C=C1)Cl)C(F)(F)F

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)SC1=CC(=C(C=C1)Cl)C(F)(F)F

InChI

InChI=1S/C13H14ClF3N2O2S/c1-6(2)10(11(20)19-12(18)21)22-7-3-4-9(14)8(5-7)13(15,16)17/h3-6,10H,1-2H3,(H3,18,19,20,21)