N-(3-chloranyl-2-fluoranyl-phenyl)-1-(3-methylquinolin-8-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-2-fluoranyl-phenyl)-1-(3-methylquinolin-8-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-chloro-2-fluoro-phenyl)-1-[(3-methyl-8-quinolyl)sulfonyl]piperidine-4-carboxamide CAS Name: N-(3-chloro-2-fluorophenyl)-1-[(3-methyl-8-quinolinyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(3-chloro-2-fluorophenyl)-1-(3-methylquinolin-8-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-chloro-2-fluoro-phenyl)-1-[(3-methyl-8-quinolyl)sulfonyl]isonipecotamide Formula: C22H21ClFN3O3S MolecularWeight: 461.936843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCC(CC3)C(=O)NC4=C(C(=CC=C4)Cl)F

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)N3CCC(CC3)C(=O)NC4=C(C(=CC=C4)Cl)F

InChI

InChI=1S/C22H21ClFN3O3S/c1-14-12-16-4-2-7-19(21(16)25-13-14)31(29,30)27-10-8-15(9-11-27)22(28)26-18-6-3-5-17(23)20(18)24/h2-7,12-13,15H,8-11H2,1H3,(H,26,28)