[3-[2-[4-[1H-benzimidazol-2-yl(furan-2-ylmethyl)amino]piperidin-1-yl]ethyl]-3-[3,4-bis(fluoranyl)phenyl]piperidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone

Systemtic Name: [3-[2-[4-[1H-benzimidazol-2-yl(furan-2-ylmethyl)amino]piperidin-1-yl]ethyl]-3-[3,4-bis(fluoranyl)phenyl]piperidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Openeye Name: [3-[2-[4-[1H-benzimidazol-2-yl(2-furylmethyl)amino]-1-piperidyl]ethyl]-3-(3,4-difluorophenyl)-1-piperidyl]-(3,4,5-trimethoxyphenyl)methanone CAS Name: [3-[2-[4-[1H-benzimidazol-2-yl(2-furanylmethyl)amino]-1-piperidinyl]ethyl]-3-(3,4-difluorophenyl)-1-piperidinyl]-(3,4,5-trimethoxyphenyl)methanone IUPAC Name: [3-[2-[4-[1H-benzimidazol-2-yl(furan-2-ylmethyl)amino]piperidin-1-yl]ethyl]-3-(3,4-difluorophenyl)piperidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Traditional Name: [3-[2-[4-[1H-benzimidazol-2-yl(2-furfuryl)amino]piperidino]ethyl]-3-(3,4-difluorophenyl)piperidino]-(3,4,5-trimethoxyphenyl)methanone Formula: C40H45F2N5O5 MolecularWeight: 713.812606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCCC(C2)(CCN3CCC(CC3)N(CC4=CC=CO4)C5=NC6=CC=CC=C6N5)C7=CC(=C(C=C7)F)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCCC(C2)(CCN3CCC(CC3)N(CC4=CC=CO4)C5=NC6=CC=CC=C6N5)C7=CC(=C(C=C7)F)F

InChI

InChI=1S/C40H45F2N5O5/c1-49-35-22-27(23-36(50-2)37(35)51-3)38(48)46-17-7-15-40(26-46,28-11-12-31(41)32(42)24-28)16-20-45-18-13-29(14-19-45)47(25-30-8-6-21-52-30)39-43-33-9-4-5-10-34(33)44-39/h4-6,8-12,21-24,29H,7,13-20,25-26H2,1-3H3,(H,43,44)