N-(1-azabicyclo[2.2.2]octan-3-yl)-7-ethynyl-pyrrolo[1,2-c]pyrimidine-3-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-7-ethynyl-pyrrolo[1,2-c]pyrimidine-3-carboxamide Openeye Name: 7-ethynyl-N-quinuclidin-3-yl-pyrrolo[1,2-c]pyrimidine-3-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-7-ethynyl-3-pyrrolo[1,2-c]pyrimidinecarboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-7-ethynylpyrrolo[1,2-c]pyrimidine-3-carboxamide Traditional Name: 7-ethynyl-N-quinuclidin-3-yl-pyrrolo[1,2-c]pyrimidine-3-carboxamide Formula: C17H18N4O MolecularWeight: 294.35102

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=C2N1C=NC(=C2)C(=O)NC3CN4CCC3CC4

Isomeric SMILES

C#CC1=CC=C2N1C=NC(=C2)C(=O)NC3CN4CCC3CC4

InChI

InChI=1S/C17H18N4O/c1-2-13-3-4-14-9-15(18-11-21(13)14)17(22)19-16-10-20-7-5-12(16)6-8-20/h1,3-4,9,11-12,16H,5-8,10H2,(H,19,22)