2-[(2R)-3-azaniumyl-2-oxidanyl-propyl]sulfanyl-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[(2R)-3-azaniumyl-2-oxidanyl-propyl]sulfanyl-6-methyl-pyrimidin-4-olate Openeye Name: 2-[(2R)-3-azaniumyl-2-hydroxy-propyl]sulfanyl-6-methyl-pyrimidin-4-olate CAS Name: 2-[[(2R)-3-ammonio-2-hydroxypropyl]thio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[(2R)-3-azaniumyl-2-hydroxypropyl]sulfanyl-6-methylpyrimidin-4-olate Traditional Name: 2-[[(2R)-3-ammonio-2-hydroxy-propyl]thio]-6-methyl-pyrimidin-4-olate Formula: C8H13N3O2S MolecularWeight: 215.27272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(C[NH3+])O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SC[C@@H](C[NH3+])O)[O-]

InChI

InChI=1S/C8H13N3O2S/c1-5-2-7(13)11-8(10-5)14-4-6(12)3-9/h2,6,12H,3-4,9H2,1H3,(H,10,11,13)/t6-/m1/s1