(2S)-3-cyano-N-[(5S)-5-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]-6-oxidanyl-hexyl]-2-(phenylsulfonylamino)propanamide

Systemtic Name: (2S)-3-cyano-N-[(5S)-5-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]-6-oxidanyl-hexyl]-2-(phenylsulfonylamino)propanamide Openeye Name: (2S)-2-(benzenesulfonamido)-3-cyano-N-[(5S)-6-hydroxy-5-[isobutyl(p-tolylsulfonyl)amino]hexyl]propanamide CAS Name: (2S)-2-(benzenesulfonamido)-3-cyano-N-[(5S)-6-hydroxy-5-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]hexyl]propanamide IUPAC Name: (2S)-2-(benzenesulfonamido)-3-cyano-N-[(5S)-6-hydroxy-5-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]hexyl]propanamide Traditional Name: (2S)-2-(benzenesulfonamido)-3-cyano-N-[(5S)-6-hydroxy-5-[isobutyl(tosyl)amino]hexyl]propionamide Formula: C27H38N4O6S2 MolecularWeight: 578.74382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(C)C)C(CCCCNC(=O)C(CC#N)NS(=O)(=O)C2=CC=CC=C2)CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(C)C)[C@@H](CCCCNC(=O)[C@H](CC#N)NS(=O)(=O)C2=CC=CC=C2)CO

InChI

InChI=1S/C27H38N4O6S2/c1-21(2)19-31(39(36,37)25-14-12-22(3)13-15-25)23(20-32)9-7-8-18-29-27(33)26(16-17-28)30-38(34,35)24-10-5-4-6-11-24/h4-6,10-15,21,23,26,30,32H,7-9,16,18-20H2,1-3H3,(H,29,33)/t23-,26-/m0/s1