2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoate Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]acetate IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]acetate Formula: C6H7N4O2S- MolecularWeight: 199.21038

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C(N=C1N)SCC(=O)[O-])N

Isomeric SMILES

C1=C(N=C(N=C1N)SCC(=O)[O-])N

InChI

InChI=1S/C6H8N4O2S/c7-3-1-4(8)10-6(9-3)13-2-5(11)12/h1H,2H2,(H,11,12)(H4,7,8,9,10)/p-1