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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC(=O)NCC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCC1C(=O)NCCC(=O)NCC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

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