2-[(2S)-3-azaniumyl-2-oxidanyl-propyl]sulfanylpyrimidin-4-olate

Systemtic Name: 2-[(2S)-3-azaniumyl-2-oxidanyl-propyl]sulfanylpyrimidin-4-olate Openeye Name: 2-[(2S)-3-azaniumyl-2-hydroxy-propyl]sulfanylpyrimidin-4-olate CAS Name: 2-[[(2S)-3-ammonio-2-hydroxypropyl]thio]-4-pyrimidinolate IUPAC Name: 2-[(2S)-3-azaniumyl-2-hydroxypropyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[[(2S)-3-ammonio-2-hydroxy-propyl]thio]pyrimidin-4-olate Formula: C7H11N3O2S MolecularWeight: 201.24614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1[O-])SCC(C[NH3+])O

Isomeric SMILES

C1=CN=C(N=C1[O-])SC[C@H](C[NH3+])O

InChI

InChI=1S/C7H11N3O2S/c8-3-5(11)4-13-7-9-2-1-6(12)10-7/h1-2,5,11H,3-4,8H2,(H,9,10,12)/t5-/m0/s1