(2S)-N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-1-(phenylsulfonyl)piperidine-2-carboxamide

Systemtic Name: (2S)-N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-1-(phenylsulfonyl)piperidine-2-carboxamide Openeye Name: (2S)-N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]-1-(benzenesulfonyl)piperidine-2-carboxamide CAS Name: (2S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-1-(benzenesulfonyl)-2-piperidinecarboxamide IUPAC Name: (2S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-1-(benzenesulfonyl)piperidine-2-carboxamide Traditional Name: (2S)-N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]-1-besyl-pipecolinamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC(CC2=CC=CC=C2)C(=O)N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN([C@@H](C1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O4S/c22-20(25)18(15-16-9-3-1-4-10-16)23-21(26)19-13-7-8-14-24(19)29(27,28)17-11-5-2-6-12-17/h1-6,9-12,18-19H,7-8,13-15H2,(H2,22,25)(H,23,26)/t18-,19-/m0/s1