N-(4-chloranyl-2-fluoranyl-phenyl)-1-(2,4,6-trimethylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-1-(2,4,6-trimethylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-chloro-2-fluoro-phenyl)-1-(2,4,6-trimethylphenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-(4-chloro-2-fluorophenyl)-1-(2,4,6-trimethylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(4-chloro-2-fluorophenyl)-1-(2,4,6-trimethylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-(4-chloro-2-fluoro-phenyl)-1-mesitylsulfonyl-pyrrolidine-2-carboxamide Formula: C20H22ClFN2O3S MolecularWeight: 424.916683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCCC2C(=O)NC3=C(C=C(C=C3)Cl)F)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCCC2C(=O)NC3=C(C=C(C=C3)Cl)F)C

InChI

InChI=1S/C20H22ClFN2O3S/c1-12-9-13(2)19(14(3)10-12)28(26,27)24-8-4-5-18(24)20(25)23-17-7-6-15(21)11-16(17)22/h6-7,9-11,18H,4-5,8H2,1-3H3,(H,23,25)