[4-[4-[[1-benzothiophen-2-ylmethyl(methyl)amino]methyl]phenoxy]piperidin-1-yl]-pyridin-4-yl-methanone

Systemtic Name: [4-[4-[[1-benzothiophen-2-ylmethyl(methyl)amino]methyl]phenoxy]piperidin-1-yl]-pyridin-4-yl-methanone Openeye Name: [4-[4-[[benzothiophen-2-ylmethyl(methyl)amino]methyl]phenoxy]-1-piperidyl]-(4-pyridyl)methanone CAS Name: [4-[4-[[1-benzothiophen-2-ylmethyl(methyl)amino]methyl]phenoxy]-1-piperidinyl]-pyridin-4-ylmethanone IUPAC Name: [4-[4-[[1-benzothiophen-2-ylmethyl(methyl)amino]methyl]phenoxy]piperidin-1-yl]-pyridin-4-ylmethanone Traditional Name: [4-[4-[[benzothiophen-2-ylmethyl(methyl)amino]methyl]phenoxy]piperidino]-(4-pyridyl)methanone Formula: C28H29N3O2S MolecularWeight: 471.61376

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)OC2CCN(CC2)C(=O)C3=CC=NC=C3)CC4=CC5=CC=CC=C5S4

Isomeric SMILES

CN(CC1=CC=C(C=C1)OC2CCN(CC2)C(=O)C3=CC=NC=C3)CC4=CC5=CC=CC=C5S4

InChI

InChI=1S/C28H29N3O2S/c1-30(20-26-18-23-4-2-3-5-27(23)34-26)19-21-6-8-24(9-7-21)33-25-12-16-31(17-13-25)28(32)22-10-14-29-15-11-22/h2-11,14-15,18,25H,12-13,16-17,19-20H2,1H3