N-(3-acetamido-4-fluoranyl-phenyl)-1-(2,4,6-trimethylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(3-acetamido-4-fluoranyl-phenyl)-1-(2,4,6-trimethylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-(3-acetamido-4-fluoro-phenyl)-1-(2,4,6-trimethylphenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: N-(3-acetamido-4-fluorophenyl)-1-(2,4,6-trimethylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-(3-acetamido-4-fluorophenyl)-1-(2,4,6-trimethylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-(3-acetamido-4-fluoro-phenyl)-1-mesitylsulfonyl-pyrrolidine-2-carboxamide Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26FN3O4S/c1-13-10-14(2)21(15(3)11-13)31(29,30)26-9-5-6-20(26)22(28)25-17-7-8-18(23)19(12-17)24-16(4)27/h7-8,10-12,20H,5-6,9H2,1-4H3,(H,24,27)(H,25,28)