1-(4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonyl-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-(4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonyl-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-(4-fluoro-3-pyrrolidin-1-ylsulfonyl-benzoyl)-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[[4-fluoro-3-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-(4-fluoro-3-pyrrolidin-1-ylsulfonylbenzoyl)-N-phenylpiperidine-4-carboxamide Traditional Name: 1-(4-fluoro-3-pyrrolidinosulfonyl-benzoyl)-N-phenyl-isonipecotamide Formula: C23H26FN3O4S MolecularWeight: 459.533643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCC(CC3)C(=O)NC4=CC=CC=C4)F

InChI

InChI=1S/C23H26FN3O4S/c24-20-9-8-18(16-21(20)32(30,31)27-12-4-5-13-27)23(29)26-14-10-17(11-15-26)22(28)25-19-6-2-1-3-7-19/h1-3,6-9,16-17H,4-5,10-15H2,(H,25,28)