(3S)-1-(4-fluorophenyl)sulfonyl-N-[3-oxidanylidene-3-(phenethylamino)propyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[3-oxidanylidene-3-(phenethylamino)propyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[3-oxo-3-(phenethylamino)propyl]piperidine-3-carboxamide CAS Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[3-oxo-3-(phenethylamino)propyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[3-oxo-3-(phenethylamino)propyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[3-keto-3-(phenethylamino)propyl]nipecotamide Formula: C23H28FN3O4S MolecularWeight: 461.549523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C23H28FN3O4S/c24-20-8-10-21(11-9-20)32(30,31)27-16-4-7-19(17-27)23(29)26-15-13-22(28)25-14-12-18-5-2-1-3-6-18/h1-3,5-6,8-11,19H,4,7,12-17H2,(H,25,28)(H,26,29)/t19-/m0/s1