methyl 2-(6-azanyl-3,5-dicyano-pyrazin-2-yl)sulfanylethanoate

Systemtic Name: methyl 2-(6-azanyl-3,5-dicyano-pyrazin-2-yl)sulfanylethanoate Openeye Name: methyl 2-(6-amino-3,5-dicyano-pyrazin-2-yl)sulfanylacetate CAS Name: 2-[(6-amino-3,5-dicyano-2-pyrazinyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(6-amino-3,5-dicyanopyrazin-2-yl)sulfanylacetate Traditional Name: 2-[(6-amino-3,5-dicyano-pyrazin-2-yl)thio]acetic acid methyl ester Formula: C9H7N5O2S MolecularWeight: 249.24918

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC(=C(N=C1C#N)C#N)N

Isomeric SMILES

COC(=O)CSC1=NC(=C(N=C1C#N)C#N)N

InChI

InChI=1S/C9H7N5O2S/c1-16-7(15)4-17-9-6(3-11)13-5(2-10)8(12)14-9/h4H2,1H3,(H2,12,14)