N-[[3,5-bis(fluoranyl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[[3,5-bis(fluoranyl)phenyl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[(3,5-difluorophenyl)methyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[(3,5-difluorophenyl)methyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[(3,5-difluorophenyl)methyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(3,5-difluorobenzyl)-1-(2-thienylsulfonyl)nipecotamide Formula: C17H18F2N2O3S2 MolecularWeight: 400.463226

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCC3=CC(=CC(=C3)F)F

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCC3=CC(=CC(=C3)F)F

InChI

InChI=1S/C17H18F2N2O3S2/c18-14-7-12(8-15(19)9-14)10-20-17(22)13-3-1-5-21(11-13)26(23,24)16-4-2-6-25-16/h2,4,6-9,13H,1,3,5,10-11H2,(H,20,22)