2-[2-[4-(1-benzothiophen-7-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-1-cyclohexyl-2-pyridin-2-yl-propane-1,3-diol

Systemtic Name: 2-[2-[4-(1-benzothiophen-7-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-1-cyclohexyl-2-pyridin-2-yl-propane-1,3-diol Openeye Name: 2-[2-[4-(benzothiophen-7-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-1-cyclohexyl-2-(2-pyridyl)propane-1,3-diol CAS Name: 2-[2-[4-(1-benzothiophen-7-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-1-cyclohexyl-2-(2-pyridinyl)propane-1,3-diol IUPAC Name: 2-[2-[4-(1-benzothiophen-7-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-1-cyclohexyl-2-pyridin-2-ylpropane-1,3-diol Traditional Name: 2-[2-[4-(benzothiophen-7-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-1-cyclohexyl-2-(2-pyridyl)propane-1,3-diol Formula: C29H36N2O2S MolecularWeight: 476.67334

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C(CCN2CCC(=CC2)C3=CC=CC4=C3SC=C4)(CO)C5=CC=CC=N5)O

Isomeric SMILES

C1CCC(CC1)C(C(CCN2CCC(=CC2)C3=CC=CC4=C3SC=C4)(CO)C5=CC=CC=N5)O

InChI

InChI=1S/C29H36N2O2S/c32-21-29(26-11-4-5-16-30-26,28(33)24-7-2-1-3-8-24)15-19-31-17-12-22(13-18-31)25-10-6-9-23-14-20-34-27(23)25/h4-6,9-12,14,16,20,24,28,32-33H,1-3,7-8,13,15,17-19,21H2