(2S)-2-(1-benzofuran-5-ylsulfonylamino)-N,N-bis(2-methylpropyl)-6-(2-pyridin-3-ylethanoylamino)hexanamide

Systemtic Name: (2S)-2-(1-benzofuran-5-ylsulfonylamino)-N,N-bis(2-methylpropyl)-6-(2-pyridin-3-ylethanoylamino)hexanamide Openeye Name: (2S)-2-(benzofuran-5-ylsulfonylamino)-N,N-diisobutyl-6-[[2-(3-pyridyl)acetyl]amino]hexanamide CAS Name: (2S)-2-(5-benzofuranylsulfonylamino)-N,N-bis(2-methylpropyl)-6-[[1-oxo-2-(3-pyridinyl)ethyl]amino]hexanamide IUPAC Name: (2S)-2-(1-benzofuran-5-ylsulfonylamino)-N,N-bis(2-methylpropyl)-6-[(2-pyridin-3-ylacetyl)amino]hexanamide Traditional Name: (2S)-2-(benzofuran-5-ylsulfonylamino)-N,N-diisobutyl-6-[[2-(3-pyridyl)acetyl]amino]hexanamide Formula: C29H40N4O5S MolecularWeight: 556.7167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C(=O)C(CCCCNC(=O)CC1=CN=CC=C1)NS(=O)(=O)C2=CC3=C(C=C2)OC=C3

Isomeric SMILES

CC(C)CN(CC(C)C)C(=O)[C@H](CCCCNC(=O)CC1=CN=CC=C1)NS(=O)(=O)C2=CC3=C(C=C2)OC=C3

InChI

InChI=1S/C29H40N4O5S/c1-21(2)19-33(20-22(3)4)29(35)26(9-5-6-14-31-28(34)16-23-8-7-13-30-18-23)32-39(36,37)25-10-11-27-24(17-25)12-15-38-27/h7-8,10-13,15,17-18,21-22,26,32H,5-6,9,14,16,19-20H2,1-4H3,(H,31,34)/t26-/m0/s1