4-[2-[4-[1H-benzimidazol-2-yl(pyridin-2-ylmethyl)amino]piperidin-1-yl]ethyl]-4-(phenylmethyl)-1-[(3,4,5-trimethoxyphenyl)methyl]pyrrolidin-2-one

Systemtic Name: 4-[2-[4-[1H-benzimidazol-2-yl(pyridin-2-ylmethyl)amino]piperidin-1-yl]ethyl]-4-(phenylmethyl)-1-[(3,4,5-trimethoxyphenyl)methyl]pyrrolidin-2-one Openeye Name: 4-[2-[4-[1H-benzimidazol-2-yl(2-pyridylmethyl)amino]-1-piperidyl]ethyl]-4-benzyl-1-[(3,4,5-trimethoxyphenyl)methyl]pyrrolidin-2-one CAS Name: 4-[2-[4-[1H-benzimidazol-2-yl(2-pyridinylmethyl)amino]-1-piperidinyl]ethyl]-4-(phenylmethyl)-1-[(3,4,5-trimethoxyphenyl)methyl]-2-pyrrolidinone IUPAC Name: 4-[2-[4-[1H-benzimidazol-2-yl(pyridin-2-ylmethyl)amino]piperidin-1-yl]ethyl]-4-benzyl-1-[(3,4,5-trimethoxyphenyl)methyl]pyrrolidin-2-one Traditional Name: 4-[2-[4-[1H-benzimidazol-2-yl(2-pyridylmethyl)amino]piperidino]ethyl]-4-benzyl-1-(3,4,5-trimethoxybenzyl)-2-pyrrolidone Formula: C41H48N6O4 MolecularWeight: 688.85762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CN2CC(CC2=O)(CCN3CCC(CC3)N(CC4=CC=CC=N4)C5=NC6=CC=CC=C6N5)CC7=CC=CC=C7

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CN2CC(CC2=O)(CCN3CCC(CC3)N(CC4=CC=CC=N4)C5=NC6=CC=CC=C6N5)CC7=CC=CC=C7

InChI

InChI=1S/C41H48N6O4/c1-49-36-23-31(24-37(50-2)39(36)51-3)27-46-29-41(26-38(46)48,25-30-11-5-4-6-12-30)18-22-45-20-16-33(17-21-45)47(28-32-13-9-10-19-42-32)40-43-34-14-7-8-15-35(34)44-40/h4-15,19,23-24,33H,16-18,20-22,25-29H2,1-3H3,(H,43,44)