1-(4-fluorophenyl)sulfonyl-N-[(2S)-1-oxidanylidene-1-(pyridin-2-ylmethylamino)propan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-[(2S)-1-oxidanylidene-1-(pyridin-2-ylmethylamino)propan-2-yl]piperidine-4-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-[(1S)-1-methyl-2-oxo-2-(2-pyridylmethylamino)ethyl]piperidine-4-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-[(2S)-1-oxo-1-(2-pyridinylmethylamino)propan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-[(2S)-1-oxo-1-(pyridin-2-ylmethylamino)propan-2-yl]piperidine-4-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-[(1S)-2-keto-1-methyl-2-(2-pyridylmethylamino)ethyl]isonipecotamide Formula: C21H25FN4O4S MolecularWeight: 448.511003

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=N1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CC=N1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN4O4S/c1-15(20(27)24-14-18-4-2-3-11-23-18)25-21(28)16-9-12-26(13-10-16)31(29,30)19-7-5-17(22)6-8-19/h2-8,11,15-16H,9-10,12-14H2,1H3,(H,24,27)(H,25,28)/t15-/m0/s1