methyl-[(2S)-3-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-2-oxidanyl-propyl]azanium

Systemtic Name: methyl-[(2S)-3-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]propyl]-methyl-ammonium CAS Name: [(2S)-2-hydroxy-3-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]propyl]-methylammonium IUPAC Name: [(2S)-2-hydroxy-3-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]propyl]-methylazanium Traditional Name: [(2S)-2-hydroxy-3-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]propyl]-methyl-ammonium Formula: C9H16N3O2S+ MolecularWeight: 230.30724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC(C[NH2+]C)O

Isomeric SMILES

CC1=CC(=O)N=C(N1)SC[C@H](C[NH2+]C)O

InChI

InChI=1S/C9H15N3O2S/c1-6-3-8(14)12-9(11-6)15-5-7(13)4-10-2/h3,7,10,13H,4-5H2,1-2H3,(H,11,12,14)/p+1/t7-/m0/s1