N-[(8-phenethylsulfonyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-2-amine

Systemtic Name: N-[(8-phenethylsulfonyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-2-amine Openeye Name: N-[(8-phenethylsulfonyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-2-amine CAS Name: N-[(8-phenethylsulfonyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-2-pyrimidinamine IUPAC Name: N-[(8-phenethylsulfonyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]pyrimidin-2-amine Traditional Name: (8-phenethylsulfonyl-8-azabicyclo[3.2.1]octan-3-yl)methyl-(2-pyrimidyl)amine Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC1N2S(=O)(=O)CCC3=CC=CC=C3)CNC4=NC=CC=N4

Isomeric SMILES

C1CC2CC(CC1N2S(=O)(=O)CCC3=CC=CC=C3)CNC4=NC=CC=N4

InChI

InChI=1S/C20H26N4O2S/c25-27(26,12-9-16-5-2-1-3-6-16)24-18-7-8-19(24)14-17(13-18)15-23-20-21-10-4-11-22-20/h1-6,10-11,17-19H,7-9,12-15H2,(H,21,22,23)