3-pyrimidin-2-ylsulfonyl-N-[5-(trifluoromethyl)pyridin-2-yl]-8-azabicyclo[3.2.1]octane-8-carboxamide

Systemtic Name: 3-pyrimidin-2-ylsulfonyl-N-[5-(trifluoromethyl)pyridin-2-yl]-8-azabicyclo[3.2.1]octane-8-carboxamide Openeye Name: 3-pyrimidin-2-ylsulfonyl-N-[5-(trifluoromethyl)-2-pyridyl]-8-azabicyclo[3.2.1]octane-8-carboxamide CAS Name: 3-(2-pyrimidinylsulfonyl)-N-[5-(trifluoromethyl)-2-pyridinyl]-8-azabicyclo[3.2.1]octane-8-carboxamide IUPAC Name: 3-pyrimidin-2-ylsulfonyl-N-[5-(trifluoromethyl)pyridin-2-yl]-8-azabicyclo[3.2.1]octane-8-carboxamide Traditional Name: 3-(2-pyrimidylsulfonyl)-N-[5-(trifluoromethyl)-2-pyridyl]-8-azabicyclo[3.2.1]octane-8-carboxamide Formula: C18H18F3N5O3S MolecularWeight: 441.42743

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC1N2C(=O)NC3=NC=C(C=C3)C(F)(F)F)S(=O)(=O)C4=NC=CC=N4

Isomeric SMILES

C1CC2CC(CC1N2C(=O)NC3=NC=C(C=C3)C(F)(F)F)S(=O)(=O)C4=NC=CC=N4

InChI

InChI=1S/C18H18F3N5O3S/c19-18(20,21)11-2-5-15(24-10-11)25-17(27)26-12-3-4-13(26)9-14(8-12)30(28,29)16-22-6-1-7-23-16/h1-2,5-7,10,12-14H,3-4,8-9H2,(H,24,25,27)