(3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-(isopropylamino)-2-oxo-ethyl]piperidine-3-carboxamide CAS Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-(isopropylamino)-2-keto-ethyl]nipecotamide Formula: C17H24FN3O4S MolecularWeight: 385.453563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)NC(=O)CNC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H24FN3O4S/c1-12(2)20-16(22)10-19-17(23)13-4-3-9-21(11-13)26(24,25)15-7-5-14(18)6-8-15/h5-8,12-13H,3-4,9-11H2,1-2H3,(H,19,23)(H,20,22)/t13-/m0/s1