2-azanyl-4-ethoxy-N-[8-(phenylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]pyrimidine-5-carboxamide

Systemtic Name: 2-azanyl-4-ethoxy-N-[8-(phenylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]pyrimidine-5-carboxamide Openeye Name: 2-amino-N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-4-ethoxy-pyrimidine-5-carboxamide CAS Name: 2-amino-4-ethoxy-N-[8-(phenylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]-5-pyrimidinecarboxamide IUPAC Name: 2-amino-N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-4-ethoxypyrimidine-5-carboxamide Traditional Name: 2-amino-N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-4-ethoxy-pyrimidine-5-carboxamide Formula: C21H27N5O2 MolecularWeight: 381.47138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC=C1C(=O)NC2CC3CCC(C2)N3CC4=CC=CC=C4)N

Isomeric SMILES

CCOC1=NC(=NC=C1C(=O)NC2CC3CCC(C2)N3CC4=CC=CC=C4)N

InChI

InChI=1S/C21H27N5O2/c1-2-28-20-18(12-23-21(22)25-20)19(27)24-15-10-16-8-9-17(11-15)26(16)13-14-6-4-3-5-7-14/h3-7,12,15-17H,2,8-11,13H2,1H3,(H,24,27)(H2,22,23,25)