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

Systemtic Name: 3-(4-methoxyphenyl)-8-[(2-methylsulfanylpyrimidin-5-yl)methyl]-8-azabicyclo[3.2.1]octan-3-ol Openeye Name: 3-(4-methoxyphenyl)-8-[(2-methylsulfanylpyrimidin-5-yl)methyl]-8-azabicyclo[3.2.1]octan-3-ol CAS Name: 3-(4-methoxyphenyl)-8-[[2-(methylthio)-5-pyrimidinyl]methyl]-8-azabicyclo[3.2.1]octan-3-ol IUPAC Name: 3-(4-methoxyphenyl)-8-[(2-methylsulfanylpyrimidin-5-yl)methyl]-8-azabicyclo[3.2.1]octan-3-ol Traditional Name: 3-(4-methoxyphenyl)-8-[[2-(methylthio)pyrimidin-5-yl]methyl]-8-azabicyclo[3.2.1]octan-3-ol Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CC3CCC(C2)N3CC4=CN=C(N=C4)SC)O

Isomeric SMILES

COC1=CC=C(C=C1)C2(CC3CCC(C2)N3CC4=CN=C(N=C4)SC)O

InChI

InChI=1S/C20H25N3O2S/c1-25-18-7-3-15(4-8-18)20(24)9-16-5-6-17(10-20)23(16)13-14-11-21-19(26-2)22-12-14/h3-4,7-8,11-12,16-17,24H,5-6,9-10,13H2,1-2H3