(Z)-N-(1-azabicyclo[2.2.2]octan-3-yl)-3-pyrimidin-2-ylsulfanyl-prop-2-enamide

Systemtic Name: (Z)-N-(1-azabicyclo[2.2.2]octan-3-yl)-3-pyrimidin-2-ylsulfanyl-prop-2-enamide Openeye Name: (Z)-3-pyrimidin-2-ylsulfanyl-N-quinuclidin-3-yl-prop-2-enamide CAS Name: (Z)-N-(1-azabicyclo[2.2.2]octan-3-yl)-3-(2-pyrimidinylthio)-2-propenamide IUPAC Name: (Z)-N-(1-azabicyclo[2.2.2]octan-3-yl)-3-pyrimidin-2-ylsulfanylprop-2-enamide Traditional Name: (Z)-3-(2-pyrimidylthio)-N-quinuclidin-3-yl-acrylamide Formula: C14H18N4OS MolecularWeight: 290.38392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC(=O)C=CSC3=NC=CC=N3

Isomeric SMILES

C1CN2CCC1C(C2)NC(=O)/C=C\SC3=NC=CC=N3

InChI

InChI=1S/C14H18N4OS/c19-13(4-9-20-14-15-5-1-6-16-14)17-12-10-18-7-2-11(12)3-8-18/h1,4-6,9,11-12H,2-3,7-8,10H2,(H,17,19)/b9-4-