2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-2-methyl-propanoate

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-2-methyl-propanoate Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-2-methyl-propanoate CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-2-methylpropanoate IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-2-methylpropanoate Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-2-methyl-propionate Formula: C8H10N3O3S- MolecularWeight: 228.2483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)[O-])SC1=NC(=O)C=C(N1)N

Isomeric SMILES

CC(C)(C(=O)[O-])SC1=NC(=O)C=C(N1)N

InChI

InChI=1S/C8H11N3O3S/c1-8(2,6(13)14)15-7-10-4(9)3-5(12)11-7/h3H,1-2H3,(H,13,14)(H3,9,10,11,12)/p-1