5-(1H-benzimidazol-2-yl)-3-ethyl-1-[(4-fluorophenyl)methyl]-4-oxidanyl-3-(phenylmethyl)-4-piperidin-1-yl-pyrrolidin-2-one; methanesulfonate

Systemtic Name: 5-(1H-benzimidazol-2-yl)-3-ethyl-1-[(4-fluorophenyl)methyl]-4-oxidanyl-3-(phenylmethyl)-4-piperidin-1-yl-pyrrolidin-2-one; methanesulfonate Openeye Name: 5-(1H-benzimidazol-2-yl)-3-benzyl-3-ethyl-1-[(4-fluorophenyl)methyl]-4-hydroxy-4-(1-piperidyl)pyrrolidin-2-one; methanesulfonate CAS Name: 5-(1H-benzimidazol-2-yl)-3-ethyl-1-[(4-fluorophenyl)methyl]-4-hydroxy-3-(phenylmethyl)-4-(1-piperidinyl)-2-pyrrolidinone; methanesulfonate IUPAC Name: 5-(1H-benzimidazol-2-yl)-3-benzyl-3-ethyl-1-[(4-fluorophenyl)methyl]-4-hydroxy-4-piperidin-1-ylpyrrolidin-2-one; methanesulfonate Traditional Name: 5-(1H-benzimidazol-2-yl)-3-benzyl-3-ethyl-1-(4-fluorobenzyl)-4-hydroxy-4-piperidino-2-pyrrolidone mesylate Formula: C33H38FN4O5S- MolecularWeight: 621.742023

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)N(C(C1(N2CCCCC2)O)C3=NC4=CC=CC=C4N3)CC5=CC=C(C=C5)F)CC6=CC=CC=C6.CS(=O)(=O)[O-]

Isomeric SMILES

CCC1(C(=O)N(C(C1(N2CCCCC2)O)C3=NC4=CC=CC=C4N3)CC5=CC=C(C=C5)F)CC6=CC=CC=C6.CS(=O)(=O)[O-]

InChI

InChI=1S/C32H35FN4O2.CH4O3S/c1-2-31(21-23-11-5-3-6-12-23)30(38)37(22-24-15-17-25(33)18-16-24)28(32(31,39)36-19-9-4-10-20-36)29-34-26-13-7-8-14-27(26)35-29;1-5(2,3)4/h3,5-8,11-18,28,39H,2,4,9-10,19-22H2,1H3,(H,34,35);1H3,(H,2,3,4)/p-1