N-[1-(4-bromophenyl)propyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[1-(4-bromophenyl)propyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[1-(4-bromophenyl)propyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[1-(4-bromophenyl)propyl]-1-(4-fluorophenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-[1-(4-bromophenyl)propyl]-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[1-(4-bromophenyl)propyl]-1-(4-fluorophenyl)sulfonyl-nipecotamide Formula: C21H24BrFN2O3S MolecularWeight: 483.394263

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCC(C1=CC=C(C=C1)Br)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H24BrFN2O3S/c1-2-20(15-5-7-17(22)8-6-15)24-21(26)16-4-3-13-25(14-16)29(27,28)19-11-9-18(23)10-12-19/h5-12,16,20H,2-4,13-14H2,1H3,(H,24,26)