(3S)-N-(3-chloranyl-2-fluoranyl-phenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(3-chloranyl-2-fluoranyl-phenyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(3-chloro-2-fluoro-phenyl)-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: (3S)-N-(3-chloro-2-fluorophenyl)-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(3-chloro-2-fluorophenyl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(3-chloro-2-fluoro-phenyl)-1-(2-thienylsulfonyl)nipecotamide Formula: C16H16ClFN2O3S2 MolecularWeight: 402.891243

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=C(C(=CC=C3)Cl)F

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=C(C(=CC=C3)Cl)F

InChI

InChI=1S/C16H16ClFN2O3S2/c17-12-5-1-6-13(15(12)18)19-16(21)11-4-2-8-20(10-11)25(22,23)14-7-3-9-24-14/h1,3,5-7,9,11H,2,4,8,10H2,(H,19,21)/t11-/m0/s1