(2S)-1-(1-benzofuran-4-yloxy)-3-[3-(7-methyl-1-benzothiophen-2-yl)-8-azabicyclo[3.2.1]octan-8-yl]propan-2-ol

Systemtic Name: (2S)-1-(1-benzofuran-4-yloxy)-3-[3-(7-methyl-1-benzothiophen-2-yl)-8-azabicyclo[3.2.1]octan-8-yl]propan-2-ol Openeye Name: (2S)-1-(benzofuran-4-yloxy)-3-[3-(7-methylbenzothiophen-2-yl)-8-azabicyclo[3.2.1]octan-8-yl]propan-2-ol CAS Name: (2S)-1-(4-benzofuranyloxy)-3-[3-(7-methyl-1-benzothiophen-2-yl)-8-azabicyclo[3.2.1]octan-8-yl]-2-propanol IUPAC Name: (2S)-1-(1-benzofuran-4-yloxy)-3-[3-(7-methyl-1-benzothiophen-2-yl)-8-azabicyclo[3.2.1]octan-8-yl]propan-2-ol Traditional Name: (2S)-1-(benzofuran-4-yloxy)-3-[3-(7-methylbenzothiophen-2-yl)-8-azabicyclo[3.2.1]octan-8-yl]propan-2-ol Formula: C27H29NO3S MolecularWeight: 447.58906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1SC(=C2)C3CC4CCC(C3)N4CC(COC5=CC=CC6=C5C=CO6)O

Isomeric SMILES

CC1=CC=CC2=C1SC(=C2)C3CC4CCC(C3)N4C[C@@H](COC5=CC=CC6=C5C=CO6)O

InChI

InChI=1S/C27H29NO3S/c1-17-4-2-5-18-14-26(32-27(17)18)19-12-20-8-9-21(13-19)28(20)15-22(29)16-31-25-7-3-6-24-23(25)10-11-30-24/h2-7,10-11,14,19-22,29H,8-9,12-13,15-16H2,1H3/t19?,20?,21?,22-/m0/s1