1-(4-fluorophenyl)sulfonyl-N-[3-oxidanylidene-3-[(phenylmethyl)amino]propyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-[3-oxidanylidene-3-[(phenylmethyl)amino]propyl]piperidine-4-carboxamide Openeye Name: N-[3-(benzylamino)-3-oxo-propyl]-1-(4-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-[3-oxo-3-[(phenylmethyl)amino]propyl]-4-piperidinecarboxamide IUPAC Name: N-[3-(benzylamino)-3-oxopropyl]-1-(4-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(benzylamino)-3-keto-propyl]-1-(4-fluorophenyl)sulfonyl-isonipecotamide Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26FN3O4S/c23-19-6-8-20(9-7-19)31(29,30)26-14-11-18(12-15-26)22(28)24-13-10-21(27)25-16-17-4-2-1-3-5-17/h1-9,18H,10-16H2,(H,24,28)(H,25,27)