2-[[4-chloranyl-3-(trifluoromethyl)phenyl]-methylsulfonyl-amino]-N-(2-pyrrolidin-1-ylcarbonylphenyl)ethanamide

Systemtic Name: 2-[[4-chloranyl-3-(trifluoromethyl)phenyl]-methylsulfonyl-amino]-N-(2-pyrrolidin-1-ylcarbonylphenyl)ethanamide Openeye Name: 2-[4-chloro-N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide CAS Name: 2-[4-chloro-N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-[2-[oxo(1-pyrrolidinyl)methyl]phenyl]acetamide IUPAC Name: 2-[4-chloro-N-methylsulfonyl-3-(trifluoromethyl)anilino]-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide Traditional Name: 2-[4-chloro-N-mesyl-3-(trifluoromethyl)anilino]-N-[2-(pyrrolidine-1-carbonyl)phenyl]acetamide Formula: C21H21ClF3N3O4S MolecularWeight: 503.92235

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)N2CCCC2)C3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)N2CCCC2)C3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C21H21ClF3N3O4S/c1-33(31,32)28(14-8-9-17(22)16(12-14)21(23,24)25)13-19(29)26-18-7-3-2-6-15(18)20(30)27-10-4-5-11-27/h2-3,6-9,12H,4-5,10-11,13H2,1H3,(H,26,29)