N-[1-(4-bromophenyl)ethyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(4-bromophenyl)ethyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(4-bromophenyl)ethyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(4-bromophenyl)ethyl]-1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(4-bromophenyl)ethyl]-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(4-bromophenyl)ethyl]-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C20H22BrFN2O3S MolecularWeight: 469.367683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrFN2O3S/c1-14(15-2-4-17(21)5-3-15)23-20(25)16-10-12-24(13-11-16)28(26,27)19-8-6-18(22)7-9-19/h2-9,14,16H,10-13H2,1H3,(H,23,25)