1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-quinolin-5-yl-piperidine-4-carboxamide

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-quinolin-5-yl-piperidine-4-carboxamide Openeye Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-N-(5-quinolyl)piperidine-4-carboxamide CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-N-(5-quinolinyl)-4-piperidinecarboxamide IUPAC Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-N-quinolin-5-ylpiperidine-4-carboxamide Traditional Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-N-(5-quinolyl)isonipecotamide Formula: C21H19ClFN3O3S MolecularWeight: 447.910263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC3=C2C=CC=N3)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC3=C2C=CC=N3)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H19ClFN3O3S/c22-17-13-15(6-7-18(17)23)30(28,29)26-11-8-14(9-12-26)21(27)25-20-5-1-4-19-16(20)3-2-10-24-19/h1-7,10,13-14H,8-9,11-12H2,(H,25,27)