(2S)-N-[(2S)-3-(4-cyanophenyl)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]-2-(naphthalen-2-ylsulfonylamino)propanamide

Systemtic Name: (2S)-N-[(2S)-3-(4-cyanophenyl)-1-oxidanylidene-1-piperidin-1-yl-propan-2-yl]-2-(naphthalen-2-ylsulfonylamino)propanamide Openeye Name: (2S)-N-[(1S)-1-[(4-cyanophenyl)methyl]-2-oxo-2-(1-piperidyl)ethyl]-2-(2-naphthylsulfonylamino)propanamide CAS Name: (2S)-N-[(2S)-3-(4-cyanophenyl)-1-oxo-1-(1-piperidinyl)propan-2-yl]-2-(2-naphthalenylsulfonylamino)propanamide IUPAC Name: (2S)-N-[(2S)-3-(4-cyanophenyl)-1-oxo-1-piperidin-1-ylpropan-2-yl]-2-(naphthalen-2-ylsulfonylamino)propanamide Traditional Name: (2S)-N-[(1S)-1-(4-cyanobenzyl)-2-keto-2-piperidino-ethyl]-2-(2-naphthylsulfonylamino)propionamide Formula: C28H30N4O4S MolecularWeight: 518.6272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC1=CC=C(C=C1)C#N)C(=O)N2CCCCC2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)C#N)C(=O)N2CCCCC2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C28H30N4O4S/c1-20(31-37(35,36)25-14-13-23-7-3-4-8-24(23)18-25)27(33)30-26(28(34)32-15-5-2-6-16-32)17-21-9-11-22(19-29)12-10-21/h3-4,7-14,18,20,26,31H,2,5-6,15-17H2,1H3,(H,30,33)/t20-,26-/m0/s1