(1S,4S)-2-(2-methylsulfanylpyrimidin-4-yl)-2-aza-5-azoniabicyclo[2.2.1]heptane

Systemtic Name: (1S,4S)-2-(2-methylsulfanylpyrimidin-4-yl)-2-aza-5-azoniabicyclo[2.2.1]heptane Openeye Name: (1S,4S)-2-(2-methylsulfanylpyrimidin-4-yl)-2-aza-5-azoniabicyclo[2.2.1]heptane CAS Name: (1S,4S)-2-[2-(methylthio)-4-pyrimidinyl]-2-aza-5-azoniabicyclo[2.2.1]heptane IUPAC Name: (1S,4S)-2-(2-methylsulfanylpyrimidin-4-yl)-2-aza-5-azoniabicyclo[2.2.1]heptane Traditional Name: (1S,4S)-2-[2-(methylthio)pyrimidin-4-yl]-2-aza-5-azoniabicyclo[2.2.1]heptane Formula: C10H15N4S+ MolecularWeight: 223.3179

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)N2CC3CC2C[NH2+]3

Isomeric SMILES

CSC1=NC=CC(=N1)N2C[C@@H]3C[C@H]2C[NH2+]3

InChI

InChI=1S/C10H14N4S/c1-15-10-11-3-2-9(13-10)14-6-7-4-8(14)5-12-7/h2-3,7-8,12H,4-6H2,1H3/p+1/t7-,8-/m0/s1