2-oxidanylidene-3-[2,5,6-tris(azanyl)pyrimidin-4-yl]sulfanyl-propanoic acid

Systemtic Name: 2-oxidanylidene-3-[2,5,6-tris(azanyl)pyrimidin-4-yl]sulfanyl-propanoic acid Openeye Name: 2-oxo-3-(2,5,6-triaminopyrimidin-4-yl)sulfanyl-propanoic acid CAS Name: 2-oxo-3-[(2,5,6-triamino-4-pyrimidinyl)thio]propanoic acid IUPAC Name: 2-oxo-3-(2,5,6-triaminopyrimidin-4-yl)sulfanylpropanoic acid Traditional Name: 2-keto-3-[(2,5,6-triaminopyrimidin-4-yl)thio]propionic acid Formula: C7H9N5O3S MolecularWeight: 243.24306

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)C(=O)O)SC1=NC(=NC(=C1N)N)N

Isomeric SMILES

C(C(=O)C(=O)O)SC1=NC(=NC(=C1N)N)N

InChI

InChI=1S/C7H9N5O3S/c8-3-4(9)11-7(10)12-5(3)16-1-2(13)6(14)15/h1,8H2,(H,14,15)(H4,9,10,11,12)