(2R,4R)-N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-4-[(4-chlorophenyl)methoxy]-1-[(2R)-2-(methylsulfonylamino)-4-piperidin-4-yl-butanoyl]pyrrolidine-2-carboxamide

Systemtic Name: (2R,4R)-N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-4-[(4-chlorophenyl)methoxy]-1-[(2R)-2-(methylsulfonylamino)-4-piperidin-4-yl-butanoyl]pyrrolidine-2-carboxamide Openeye Name: (2R,4R)-N-[(5-bromo-2-fluoro-phenyl)methyl]-4-[(4-chlorophenyl)methoxy]-1-[(2R)-2-(methanesulfonamido)-4-(4-piperidyl)butanoyl]pyrrolidine-2-carboxamide CAS Name: (2R,4R)-N-[(5-bromo-2-fluorophenyl)methyl]-4-[(4-chlorophenyl)methoxy]-1-[(2R)-2-(methanesulfonamido)-1-oxo-4-(4-piperidinyl)butyl]-2-pyrrolidinecarboxamide IUPAC Name: (2R,4R)-N-[(5-bromo-2-fluorophenyl)methyl]-4-[(4-chlorophenyl)methoxy]-1-[(2R)-2-(methanesulfonamido)-4-piperidin-4-ylbutanoyl]pyrrolidine-2-carboxamide Traditional Name: (2R,4R)-N-(5-bromo-2-fluoro-benzyl)-4-(4-chlorobenzyl)oxy-1-[(2R)-2-(methanesulfonamido)-4-(4-piperidyl)butanoyl]pyrrolidine-2-carboxamide Formula: C29H37BrClFN4O5S MolecularWeight: 688.048283

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC(CCC1CCNCC1)C(=O)N2CC(CC2C(=O)NCC3=C(C=CC(=C3)Br)F)OCC4=CC=C(C=C4)Cl

Isomeric SMILES

CS(=O)(=O)N[C@H](CCC1CCNCC1)C(=O)N2C[C@@H](C[C@@H]2C(=O)NCC3=C(C=CC(=C3)Br)F)OCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C29H37BrClFN4O5S/c1-42(39,40)35-26(9-4-19-10-12-33-13-11-19)29(38)36-17-24(41-18-20-2-6-23(31)7-3-20)15-27(36)28(37)34-16-21-14-22(30)5-8-25(21)32/h2-3,5-8,14,19,24,26-27,33,35H,4,9-13,15-18H2,1H3,(H,34,37)/t24-,26-,27-/m1/s1