4-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-5-methyl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-5-methyl-1,2,4-triazole-3-thiolate Openeye Name: 5-methyl-4-[(3R)-quinuclidin-1-ium-3-yl]-1,2,4-triazole-3-thiolate CAS Name: 4-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-5-methyl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-5-methyl-1,2,4-triazole-3-thiolate Traditional Name: 5-methyl-4-[(3R)-quinuclidin-1-ium-3-yl]-1,2,4-triazole-3-thiolate Formula: C10H16N4S MolecularWeight: 224.32584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2C[NH+]3CCC2CC3)[S-]

Isomeric SMILES

CC1=NN=C(N1[C@H]2C[NH+]3CCC2CC3)[S-]

InChI

InChI=1S/C10H16N4S/c1-7-11-12-10(15)14(7)9-6-13-4-2-8(9)3-5-13/h8-9H,2-6H2,1H3,(H,12,15)/t9-/m0/s1