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

Systemtic Name: (2S)-N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-1-(3-hydroxyphenyl)sulfonyl-piperidine-2-carboxamide Openeye Name: (2S)-N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]-1-(3-hydroxyphenyl)sulfonyl-piperidine-2-carboxamide CAS Name: (2S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-1-(3-hydroxyphenyl)sulfonyl-2-piperidinecarboxamide IUPAC Name: (2S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-1-(3-hydroxyphenyl)sulfonylpiperidine-2-carboxamide Traditional Name: (2S)-N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]-1-(3-hydroxyphenyl)sulfonyl-pipecolinamide Formula: C21H25N3O5S MolecularWeight: 431.5053

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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)O

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)O

InChI

InChI=1S/C21H25N3O5S/c22-20(26)18(13-15-7-2-1-3-8-15)23-21(27)19-11-4-5-12-24(19)30(28,29)17-10-6-9-16(25)14-17/h1-3,6-10,14,18-19,25H,4-5,11-13H2,(H2,22,26)(H,23,27)/t18-,19-/m0/s1