N-[2-(1-adamantyl)ethyl]-1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(1-adamantyl)ethyl]-1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(1-adamantyl)ethyl]-1-(3-chloro-4-fluoro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(1-adamantyl)ethyl]-1-(3-chloro-4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(1-adamantyl)ethyl]-1-(3-chloro-4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(1-adamantyl)ethyl]-1-(3-chloro-4-fluoro-phenyl)sulfonyl-isonipecotamide Formula: C24H32ClFN2O3S MolecularWeight: 483.038883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC(=C(C=C5)F)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NCCC23CC4CC(C2)CC(C4)C3)S(=O)(=O)C5=CC(=C(C=C5)F)Cl

InChI

InChI=1S/C24H32ClFN2O3S/c25-21-12-20(1-2-22(21)26)32(30,31)28-7-3-19(4-8-28)23(29)27-6-5-24-13-16-9-17(14-24)11-18(10-16)15-24/h1-2,12,16-19H,3-11,13-15H2,(H,27,29)