2-[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]sulfanyl-6-propyl-pyrimidin-4-olate

Systemtic Name: 2-[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]sulfanyl-6-propyl-pyrimidin-4-olate Openeye Name: 2-[(1S)-2-amino-1-methyl-2-oxo-ethyl]sulfanyl-6-propyl-pyrimidin-4-olate CAS Name: 2-[[(2S)-1-amino-1-oxopropan-2-yl]thio]-6-propyl-4-pyrimidinolate IUPAC Name: 2-[(2S)-1-amino-1-oxopropan-2-yl]sulfanyl-6-propylpyrimidin-4-olate Traditional Name: 2-[[(1S)-2-amino-2-keto-1-methyl-ethyl]thio]-6-propyl-pyrimidin-4-olate Formula: C10H14N3O2S- MolecularWeight: 240.30206

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=N1)SC(C)C(=O)N)[O-]

Isomeric SMILES

CCCC1=CC(=NC(=N1)S[C@@H](C)C(=O)N)[O-]

InChI

InChI=1S/C10H15N3O2S/c1-3-4-7-5-8(14)13-10(12-7)16-6(2)9(11)15/h5-6H,3-4H2,1-2H3,(H2,11,15)(H,12,13,14)/p-1/t6-/m0/s1