2-[[4-chloranyl-3-(trifluoromethyl)phenyl]-methylsulfonyl-amino]-N-(2-pyridin-2-ylsulfanylethyl)ethanamide

Systemtic Name: 2-[[4-chloranyl-3-(trifluoromethyl)phenyl]-methylsulfonyl-amino]-N-(2-pyridin-2-ylsulfanylethyl)ethanamide Openeye Name: 2-[4-chloro-N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-[2-(2-pyridylsulfanyl)ethyl]acetamide CAS Name: 2-[4-chloro-N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-[2-(2-pyridinylthio)ethyl]acetamide IUPAC Name: 2-[4-chloro-N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-(2-pyridin-2-ylsulfanylethyl)acetamide Traditional Name: 2-[4-chloro-N-mesyl-3-(trifluoromethyl)anilino]-N-[2-(2-pyridylthio)ethyl]acetamide Formula: C17H17ClF3N3O3S2 MolecularWeight: 467.91339

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCCSC1=CC=CC=N1)C2=CC(=C(C=C2)Cl)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCCSC1=CC=CC=N1)C2=CC(=C(C=C2)Cl)C(F)(F)F

InChI

InChI=1S/C17H17ClF3N3O3S2/c1-29(26,27)24(12-5-6-14(18)13(10-12)17(19,20)21)11-15(25)22-8-9-28-16-4-2-3-7-23-16/h2-7,10H,8-9,11H2,1H3,(H,22,25)