1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-[1-(4-ethylphenyl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-N-[1-(4-ethylphenyl)ethyl]piperidine-4-carboxamide Openeye Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-N-[1-(4-ethylphenyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-N-[1-(4-ethylphenyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-N-[1-(4-ethylphenyl)ethyl]piperidine-4-carboxamide Traditional Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-N-[1-(4-ethylphenyl)ethyl]isonipecotamide Formula: C22H26ClFN2O3S MolecularWeight: 452.969843

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C22H26ClFN2O3S/c1-3-16-4-6-17(7-5-16)15(2)25-22(27)18-10-12-26(13-11-18)30(28,29)19-8-9-21(24)20(23)14-19/h4-9,14-15,18H,3,10-13H2,1-2H3,(H,25,27)