1-[3,4-bis(fluoranyl)phenyl]sulfonyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide

Systemtic Name: 1-[3,4-bis(fluoranyl)phenyl]sulfonyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide Openeye Name: 1-(3,4-difluorophenyl)sulfonyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide CAS Name: 1-(3,4-difluorophenyl)sulfonyl-N-[3-(1-pyrazolyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-difluorophenyl)sulfonyl-N-(3-pyrazol-1-ylpropyl)piperidine-4-carboxamide Traditional Name: 1-(3,4-difluorophenyl)sulfonyl-N-(3-pyrazol-1-ylpropyl)isonipecotamide Formula: C18H22F2N4O3S MolecularWeight: 412.454086

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCCN2C=CC=N2)S(=O)(=O)C3=CC(=C(C=C3)F)F

Isomeric SMILES

C1CN(CCC1C(=O)NCCCN2C=CC=N2)S(=O)(=O)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C18H22F2N4O3S/c19-16-4-3-15(13-17(16)20)28(26,27)24-11-5-14(6-12-24)18(25)21-7-1-9-23-10-2-8-22-23/h2-4,8,10,13-14H,1,5-7,9,11-12H2,(H,21,25)