N-(5-chloranyl-2-morpholin-4-yl-phenyl)-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-morpholin-4-yl-phenyl)-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(5-chloro-2-morpholino-phenyl)-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[5-chloro-2-(4-morpholinyl)phenyl]-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(5-chloro-2-morpholin-4-ylphenyl)-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(5-chloro-2-morpholino-phenyl)-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C22H25ClFN3O4S MolecularWeight: 481.968003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)Cl)N3CCOCC3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C=CC(=C2)Cl)N3CCOCC3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H25ClFN3O4S/c23-17-1-6-21(26-11-13-31-14-12-26)20(15-17)25-22(28)16-7-9-27(10-8-16)32(29,30)19-4-2-18(24)3-5-19/h1-6,15-16H,7-14H2,(H,25,28)