2-acetamido-N-[2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]-3-methyl-butanamide

Systemtic Name: 2-acetamido-N-[2-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]-3-methyl-butanamide Openeye Name: 2-acetamido-N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethyl]-3-methyl-butanamide CAS Name: 2-acetamido-N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]ethyl]-3-methylbutanamide IUPAC Name: 2-acetamido-N-[2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanylethyl]-3-methylbutanamide Traditional Name: 2-acetamido-N-[2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]ethyl]-3-methyl-butyramide Formula: C15H19ClF3N3O2S MolecularWeight: 397.84347

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCSC1=C(C=C(C=N1)C(F)(F)F)Cl)NC(=O)C

Isomeric SMILES

CC(C)C(C(=O)NCCSC1=C(C=C(C=N1)C(F)(F)F)Cl)NC(=O)C

InChI

InChI=1S/C15H19ClF3N3O2S/c1-8(2)12(22-9(3)23)13(24)20-4-5-25-14-11(16)6-10(7-21-14)15(17,18)19/h6-8,12H,4-5H2,1-3H3,(H,20,24)(H,22,23)