3-(4-methoxyphenyl)-8-[(2-propylsulfanylpyrimidin-5-yl)methyl]-8-azabicyclo[3.2.1]octan-3-ol

Systemtic Name: 3-(4-methoxyphenyl)-8-[(2-propylsulfanylpyrimidin-5-yl)methyl]-8-azabicyclo[3.2.1]octan-3-ol Openeye Name: 3-(4-methoxyphenyl)-8-[(2-propylsulfanylpyrimidin-5-yl)methyl]-8-azabicyclo[3.2.1]octan-3-ol CAS Name: 3-(4-methoxyphenyl)-8-[[2-(propylthio)-5-pyrimidinyl]methyl]-8-azabicyclo[3.2.1]octan-3-ol IUPAC Name: 3-(4-methoxyphenyl)-8-[(2-propylsulfanylpyrimidin-5-yl)methyl]-8-azabicyclo[3.2.1]octan-3-ol Traditional Name: 3-(4-methoxyphenyl)-8-[[2-(propylthio)pyrimidin-5-yl]methyl]-8-azabicyclo[3.2.1]octan-3-ol Formula: C22H29N3O2S MolecularWeight: 399.54956

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=C(C=N1)CN2C3CCC2CC(C3)(C4=CC=C(C=C4)OC)O

Isomeric SMILES

CCCSC1=NC=C(C=N1)CN2C3CCC2CC(C3)(C4=CC=C(C=C4)OC)O

InChI

InChI=1S/C22H29N3O2S/c1-3-10-28-21-23-13-16(14-24-21)15-25-18-6-7-19(25)12-22(26,11-18)17-4-8-20(27-2)9-5-17/h4-5,8-9,13-14,18-19,26H,3,6-7,10-12,15H2,1-2H3