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

Systemtic Name: 4-ethoxy-2-ethyl-N-[8-(phenylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]pyrimidine-5-carboxamide Openeye Name: N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-4-ethoxy-2-ethyl-pyrimidine-5-carboxamide CAS Name: 4-ethoxy-2-ethyl-N-[8-(phenylmethyl)-8-azabicyclo[3.2.1]octan-3-yl]-5-pyrimidinecarboxamide IUPAC Name: N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-4-ethoxy-2-ethylpyrimidine-5-carboxamide Traditional Name: N-(8-benzyl-8-azabicyclo[3.2.1]octan-3-yl)-4-ethoxy-2-ethyl-pyrimidine-5-carboxamide Formula: C23H30N4O2 MolecularWeight: 394.5099

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=C(C(=N1)OCC)C(=O)NC2CC3CCC(C2)N3CC4=CC=CC=C4

Isomeric SMILES

CCC1=NC=C(C(=N1)OCC)C(=O)NC2CC3CCC(C2)N3CC4=CC=CC=C4

InChI

InChI=1S/C23H30N4O2/c1-3-21-24-14-20(23(26-21)29-4-2)22(28)25-17-12-18-10-11-19(13-17)27(18)15-16-8-6-5-7-9-16/h5-9,14,17-19H,3-4,10-13,15H2,1-2H3,(H,25,28)