N-[(2S,3R)-2-methyl-1-azabicyclo[2.2.2]octan-3-yl]-4-pyridin-3-yl-pyrazole-1-carboxamide

Systemtic Name: N-[(2S,3R)-2-methyl-1-azabicyclo[2.2.2]octan-3-yl]-4-pyridin-3-yl-pyrazole-1-carboxamide Openeye Name: N-[(2S,3R)-2-methylquinuclidin-3-yl]-4-(3-pyridyl)pyrazole-1-carboxamide CAS Name: N-[(2S,3R)-2-methyl-1-azabicyclo[2.2.2]octan-3-yl]-4-(3-pyridinyl)-1-pyrazolecarboxamide IUPAC Name: N-[(2S,3R)-2-methyl-1-azabicyclo[2.2.2]octan-3-yl]-4-pyridin-3-ylpyrazole-1-carboxamide Traditional Name: N-[(2S,3R)-2-methylquinuclidin-3-yl]-4-(3-pyridyl)pyrazole-1-carboxamide Formula: C17H21N5O MolecularWeight: 311.38154

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2CCN1CC2)NC(=O)N3C=C(C=N3)C4=CN=CC=C4

Isomeric SMILES

C[C@H]1[C@@H](C2CCN1CC2)NC(=O)N3C=C(C=N3)C4=CN=CC=C4

InChI

InChI=1S/C17H21N5O/c1-12-16(13-4-7-21(12)8-5-13)20-17(23)22-11-15(10-19-22)14-3-2-6-18-9-14/h2-3,6,9-13,16H,4-5,7-8H2,1H3,(H,20,23)/t12-,16-/m0/s1