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

Systemtic Name: (3S)-1-(5-bromanylthiophen-2-yl)sulfonyl-N-[2-(4-fluorophenyl)ethyl]piperidine-3-carboxamide Openeye Name: (3S)-1-[(5-bromo-2-thienyl)sulfonyl]-N-[2-(4-fluorophenyl)ethyl]piperidine-3-carboxamide CAS Name: (3S)-1-[(5-bromo-2-thiophenyl)sulfonyl]-N-[2-(4-fluorophenyl)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(5-bromothiophen-2-yl)sulfonyl-N-[2-(4-fluorophenyl)ethyl]piperidine-3-carboxamide Traditional Name: (3S)-1-[(5-bromo-2-thienyl)sulfonyl]-N-[2-(4-fluorophenyl)ethyl]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(S2)Br)C(=O)NCCC3=CC=C(C=C3)F

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(S2)Br)C(=O)NCCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H20BrFN2O3S2/c19-16-7-8-17(26-16)27(24,25)22-11-1-2-14(12-22)18(23)21-10-9-13-3-5-15(20)6-4-13/h3-8,14H,1-2,9-12H2,(H,21,23)/t14-/m0/s1