N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[[(2S)-1-ethyl-2-pyrrolidinyl]methyl]-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-1-(2-fluorophenyl)sulfonyl-isonipecotamide Formula: C19H28FN3O3S MolecularWeight: 397.507323

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CCN1CCC[C@H]1CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C19H28FN3O3S/c1-2-22-11-5-6-16(22)14-21-19(24)15-9-12-23(13-10-15)27(25,26)18-8-4-3-7-17(18)20/h3-4,7-8,15-16H,2,5-6,9-14H2,1H3,(H,21,24)/t16-/m0/s1