N-(1-azabicyclo[2.2.2]octan-3-yl)-1-methyl-5-(4-methylsulfanylphenyl)pyrrole-2-carboxamide

Systemtic Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-1-methyl-5-(4-methylsulfanylphenyl)pyrrole-2-carboxamide Openeye Name: 1-methyl-5-(4-methylsulfanylphenyl)-N-quinuclidin-3-yl-pyrrole-2-carboxamide CAS Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-1-methyl-5-[4-(methylthio)phenyl]-2-pyrrolecarboxamide IUPAC Name: N-(1-azabicyclo[2.2.2]octan-3-yl)-1-methyl-5-(4-methylsulfanylphenyl)pyrrole-2-carboxamide Traditional Name: 1-methyl-5-[4-(methylthio)phenyl]-N-quinuclidin-3-yl-pyrrole-2-carboxamide Formula: C20H25N3OS MolecularWeight: 355.497

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C(=O)NC2CN3CCC2CC3)C4=CC=C(C=C4)SC

Isomeric SMILES

CN1C(=CC=C1C(=O)NC2CN3CCC2CC3)C4=CC=C(C=C4)SC

InChI

InChI=1S/C20H25N3OS/c1-22-18(15-3-5-16(25-2)6-4-15)7-8-19(22)20(24)21-17-13-23-11-9-14(17)10-12-23/h3-8,14,17H,9-13H2,1-2H3,(H,21,24)