N-[2-chloranyl-5-(trifluoromethyl)phenyl]-1-(4-methylphenyl)sulfonyl-5-oxidanylidene-pyrrolidine-2-carboxamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-1-(4-methylphenyl)sulfonyl-5-oxidanylidene-pyrrolidine-2-carboxamide Openeye Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-5-oxo-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-1-(4-methylphenyl)sulfonyl-5-oxo-2-pyrrolidinecarboxamide IUPAC Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-1-(4-methylphenyl)sulfonyl-5-oxopyrrolidine-2-carboxamide Traditional Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-5-keto-1-tosyl-pyrrolidine-2-carboxamide Formula: C19H16ClF3N2O4S MolecularWeight: 460.85455

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC2=O)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC2=O)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C19H16ClF3N2O4S/c1-11-2-5-13(6-3-11)30(28,29)25-16(8-9-17(25)26)18(27)24-15-10-12(19(21,22)23)4-7-14(15)20/h2-7,10,16H,8-9H2,1H3,(H,24,27)