N-[(2R,5S,6S)-5-oxidanyl-1,7-diphenyl-6-[[2-(pyridin-2-ylsulfonylamino)phenyl]carbonylamino]heptan-2-yl]-2-(pyridin-2-ylsulfonylamino)benzamide

Systemtic Name: N-[(2R,5S,6S)-5-oxidanyl-1,7-diphenyl-6-[[2-(pyridin-2-ylsulfonylamino)phenyl]carbonylamino]heptan-2-yl]-2-(pyridin-2-ylsulfonylamino)benzamide Openeye Name: N-[(1R,4S,5S)-1-benzyl-4-hydroxy-6-phenyl-5-[[2-(2-pyridylsulfonylamino)benzoyl]amino]hexyl]-2-(2-pyridylsulfonylamino)benzamide CAS Name: N-[(2R,5S,6S)-5-hydroxy-6-[[oxo-[2-(2-pyridinylsulfonylamino)phenyl]methyl]amino]-1,7-diphenylheptan-2-yl]-2-(2-pyridinylsulfonylamino)benzamide IUPAC Name: N-[(2R,5S,6S)-5-hydroxy-1,7-diphenyl-6-[[2-(pyridin-2-ylsulfonylamino)benzoyl]amino]heptan-2-yl]-2-(pyridin-2-ylsulfonylamino)benzamide Traditional Name: N-[(1R,4S,5S)-1-benzyl-4-hydroxy-6-phenyl-5-[[2-(2-pyridylsulfonylamino)benzoyl]amino]hexyl]-2-(2-pyridylsulfonylamino)benzamide Formula: C43H42N6O7S2 MolecularWeight: 818.95958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CCC(C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=CC=N4)O)NC(=O)C5=CC=CC=C5NS(=O)(=O)C6=CC=CC=N6

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](CC[C@@H]([C@H](CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=CC=N4)O)NC(=O)C5=CC=CC=C5NS(=O)(=O)C6=CC=CC=N6

InChI

InChI=1S/C43H42N6O7S2/c50-39(38(30-32-17-5-2-6-18-32)47-43(52)35-20-8-10-22-37(35)49-58(55,56)41-24-12-14-28-45-41)26-25-33(29-31-15-3-1-4-16-31)46-42(51)34-19-7-9-21-36(34)48-57(53,54)40-23-11-13-27-44-40/h1-24,27-28,33,38-39,48-50H,25-26,29-30H2,(H,46,51)(H,47,52)/t33-,38+,39+/m1/s1