(3S)-N-[2-(5-bromanylthiophen-2-yl)ethyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[2-(5-bromanylthiophen-2-yl)ethyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-[2-(5-bromo-2-thienyl)ethyl]-1-(4-fluorophenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-[2-(5-bromo-2-thiophenyl)ethyl]-1-(4-fluorophenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-[2-(5-bromothiophen-2-yl)ethyl]-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-[2-(5-bromo-2-thienyl)ethyl]-1-(4-fluorophenyl)sulfonyl-nipecotamide Formula: C18H20BrFN2O3S2 MolecularWeight: 475.395403

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCC3=CC=C(S3)Br

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCC3=CC=C(S3)Br

InChI

InChI=1S/C18H20BrFN2O3S2/c19-17-8-5-15(26-17)9-10-21-18(23)13-2-1-11-22(12-13)27(24,25)16-6-3-14(20)4-7-16/h3-8,13H,1-2,9-12H2,(H,21,23)/t13-/m0/s1