2-[4,5,6-tris(azanyl)pyrimidin-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[4,5,6-tris(azanyl)pyrimidin-2-yl]sulfanylethanoic acid Openeye Name: 2-(4,5,6-triaminopyrimidin-2-yl)sulfanylacetic acid CAS Name: 2-[(4,5,6-triamino-2-pyrimidinyl)thio]acetic acid IUPAC Name: 2-(4,5,6-triaminopyrimidin-2-yl)sulfanylacetic acid Traditional Name: 2-[(4,5,6-triaminopyrimidin-2-yl)thio]acetic acid Formula: C6H9N5O2S MolecularWeight: 215.23296

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)O)SC1=NC(=C(C(=N1)N)N)N

Isomeric SMILES

C(C(=O)O)SC1=NC(=C(C(=N1)N)N)N

InChI

InChI=1S/C6H9N5O2S/c7-3-4(8)10-6(11-5(3)9)14-1-2(12)13/h1,7H2,(H,12,13)(H4,8,9,10,11)