1-(5-fluoranyl-2-methoxy-phenyl)sulfonyl-N-[(2S)-pentan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(5-fluoranyl-2-methoxy-phenyl)sulfonyl-N-[(2S)-pentan-2-yl]piperidine-4-carboxamide Openeye Name: 1-(5-fluoro-2-methoxy-phenyl)sulfonyl-N-[(1S)-1-methylbutyl]piperidine-4-carboxamide CAS Name: 1-(5-fluoro-2-methoxyphenyl)sulfonyl-N-[(2S)-pentan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(5-fluoro-2-methoxyphenyl)sulfonyl-N-[(2S)-pentan-2-yl]piperidine-4-carboxamide Traditional Name: 1-(5-fluoro-2-methoxy-phenyl)sulfonyl-N-[(1S)-1-methylbutyl]isonipecotamide Formula: C18H27FN2O4S MolecularWeight: 386.481383

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)F)OC

Isomeric SMILES

CCC[C@H](C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)F)OC

InChI

InChI=1S/C18H27FN2O4S/c1-4-5-13(2)20-18(22)14-8-10-21(11-9-14)26(23,24)17-12-15(19)6-7-16(17)25-3/h6-7,12-14H,4-5,8-11H2,1-3H3,(H,20,22)/t13-/m0/s1