(3-oxidanylidene-5-pyrazin-2-yl-1,2-dithiol-4-yl)methyl 2,2-diethoxyethanoate

Systemtic Name: (3-oxidanylidene-5-pyrazin-2-yl-1,2-dithiol-4-yl)methyl 2,2-diethoxyethanoate Openeye Name: (3-oxo-5-pyrazin-2-yl-dithiol-4-yl)methyl 2,2-diethoxyacetate CAS Name: 2,2-diethoxyacetic acid [3-oxo-5-(2-pyrazinyl)-4-dithiolyl]methyl ester IUPAC Name: (3-oxo-5-pyrazin-2-yldithiol-4-yl)methyl 2,2-diethoxyacetate Traditional Name: 2,2-diethoxyacetic acid (3-keto-5-pyrazin-2-yl-dithiol-4-yl)methyl ester Formula: C14H16N2O5S2 MolecularWeight: 356.41724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=O)OCC1=C(SSC1=O)C2=NC=CN=C2)OCC

Isomeric SMILES

CCOC(C(=O)OCC1=C(SSC1=O)C2=NC=CN=C2)OCC

InChI

InChI=1S/C14H16N2O5S2/c1-3-19-14(20-4-2)12(17)21-8-9-11(22-23-13(9)18)10-7-15-5-6-16-10/h5-7,14H,3-4,8H2,1-2H3