1-[(5R)-9-(2,2-dimethylpropyl)-3-aza-9-azoniaspiro[4.5]decan-3-yl]-2-pyridin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[(5R)-9-(2,2-dimethylpropyl)-3-aza-9-azoniaspiro[4.5]decan-3-yl]-2-pyridin-4-ylsulfanyl-ethanone Openeye Name: 1-[(5R)-9-(2,2-dimethylpropyl)-3-aza-9-azoniaspiro[4.5]decan-3-yl]-2-(4-pyridylsulfanyl)ethanone CAS Name: 1-[(5R)-9-(2,2-dimethylpropyl)-3-aza-9-azoniaspiro[4.5]decan-3-yl]-2-(pyridin-4-ylthio)ethanone IUPAC Name: 1-[(5R)-9-(2,2-dimethylpropyl)-3-aza-9-azoniaspiro[4.5]decan-3-yl]-2-pyridin-4-ylsulfanylethanone Traditional Name: 1-[(5R)-9-neopentyl-3-aza-9-azoniaspiro[4.5]decan-3-yl]-2-(4-pyridylthio)ethanone Formula: C20H32N3OS+ MolecularWeight: 362.55258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C[NH+]1CCCC2(C1)CCN(C2)C(=O)CSC3=CC=NC=C3

Isomeric SMILES

CC(C)(C)C[NH+]1CCC[C@@]2(C1)CCN(C2)C(=O)CSC3=CC=NC=C3

InChI

InChI=1S/C20H31N3OS/c1-19(2,3)14-22-11-4-7-20(15-22)8-12-23(16-20)18(24)13-25-17-5-9-21-10-6-17/h5-6,9-10H,4,7-8,11-16H2,1-3H3/p+1/t20-/m0/s1