(2S)-2-[(3S)-3-acetamido-3-[(2S)-butan-2-yl]-2-oxidanylidene-pyrrolidin-1-yl]-N-[(1R,2S)-3-[3,5-bis(fluoranyl)phenyl]-1-oxidanyl-1-[(2R,4R)-4-propoxypyrrolidin-2-yl]propan-2-yl]-4-phenyl-butanamide

Systemtic Name: (2S)-2-[(3S)-3-acetamido-3-[(2S)-butan-2-yl]-2-oxidanylidene-pyrrolidin-1-yl]-N-[(1R,2S)-3-[3,5-bis(fluoranyl)phenyl]-1-oxidanyl-1-[(2R,4R)-4-propoxypyrrolidin-2-yl]propan-2-yl]-4-phenyl-butanamide Openeye Name: (2S)-2-[(3S)-3-acetamido-3-[(1S)-1-methylpropyl]-2-oxo-pyrrolidin-1-yl]-N-[(1S,2R)-1-[(3,5-difluorophenyl)methyl]-2-hydroxy-2-[(2R,4R)-4-propoxypyrrolidin-2-yl]ethyl]-4-phenyl-butanamide CAS Name: (2S)-2-[(3S)-3-acetamido-3-[(2S)-butan-2-yl]-2-oxo-1-pyrrolidinyl]-N-[(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(2R,4R)-4-propoxy-2-pyrrolidinyl]propan-2-yl]-4-phenylbutanamide IUPAC Name: (2S)-2-[(3S)-3-acetamido-3-[(2S)-butan-2-yl]-2-oxopyrrolidin-1-yl]-N-[(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(2R,4R)-4-propoxypyrrolidin-2-yl]propan-2-yl]-4-phenylbutanamide Traditional Name: (2S)-2-[(3S)-3-acetamido-2-keto-3-[(1S)-1-methylpropyl]pyrrolidino]-N-[(1S,2R)-1-(3,5-difluorobenzyl)-2-hydroxy-2-[(2R,4R)-4-propoxypyrrolidin-2-yl]ethyl]-4-phenyl-butyramide Formula: C36H50F2N4O5 MolecularWeight: 656.802806

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1CC(NC1)C(C(CC2=CC(=CC(=C2)F)F)NC(=O)C(CCC3=CC=CC=C3)N4CCC(C4=O)(C(C)CC)NC(=O)C)O

Isomeric SMILES

CCCO[C@@H]1C[C@@H](NC1)[C@H]([C@H](CC2=CC(=CC(=C2)F)F)NC(=O)[C@H](CCC3=CC=CC=C3)N4CC[C@@](C4=O)([C@@H](C)CC)NC(=O)C)O

InChI

InChI=1S/C36H50F2N4O5/c1-5-16-47-29-21-30(39-22-29)33(44)31(19-26-17-27(37)20-28(38)18-26)40-34(45)32(13-12-25-10-8-7-9-11-25)42-15-14-36(35(42)46,23(3)6-2)41-24(4)43/h7-11,17-18,20,23,29-33,39,44H,5-6,12-16,19,21-22H2,1-4H3,(H,40,45)(H,41,43)/t23-,29+,30+,31-,32-,33+,36-/m0/s1