1-(4-fluorophenyl)sulfonyl-N-[3-oxidanylidene-3-(pyridin-2-ylmethylamino)propyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-[3-oxidanylidene-3-(pyridin-2-ylmethylamino)propyl]piperidine-4-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-[3-oxo-3-(2-pyridylmethylamino)propyl]piperidine-4-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-[3-oxo-3-(2-pyridinylmethylamino)propyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-[3-oxo-3-(pyridin-2-ylmethylamino)propyl]piperidine-4-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-[3-keto-3-(2-pyridylmethylamino)propyl]isonipecotamide Formula: C21H25FN4O4S MolecularWeight: 448.511003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC(=O)NCC2=CC=CC=N2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCC1C(=O)NCCC(=O)NCC2=CC=CC=N2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN4O4S/c22-17-4-6-19(7-5-17)31(29,30)26-13-9-16(10-14-26)21(28)24-12-8-20(27)25-15-18-3-1-2-11-23-18/h1-7,11,16H,8-10,12-15H2,(H,24,28)(H,25,27)