N-(1-azabicyclo[2.2.2]octan-3-yl)-5-cyano-pyrrolo[1,2-c]pyrimidine-3-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-cyano-pyrrolo[1,2-c]pyrimidine-3-carboxamide Openeye Name: 5-cyano-N-quinuclidin-3-yl-pyrrolo[1,2-c]pyrimidine-3-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-cyano-3-pyrrolo[1,2-c]pyrimidinecarboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-5-cyanopyrrolo[1,2-c]pyrimidine-3-carboxamide Traditional Name: 5-cyano-N-quinuclidin-3-yl-pyrrolo[1,2-c]pyrimidine-3-carboxamide Formula: C16H17N5O MolecularWeight: 295.33908

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C3=CC4=C(C=CN4C=N3)C#N

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)C3=CC4=C(C=CN4C=N3)C#N

InChI

InChI=1S/C16H17N5O/c17-8-12-3-6-21-10-18-13(7-15(12)21)16(22)19-14-9-20-4-1-11(14)2-5-20/h3,6-7,10-11,14H,1-2,4-5,9H2,(H,19,22)