methyl 5-nitro-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 5-nitro-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 5-nitro-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-nitro-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 5-nitro-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-nitro-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C8H5N3O5S MolecularWeight: 255.2074

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(S1)N=CNC2=O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C2=C(S1)N=CNC2=O)[N+](=O)[O-]

InChI

InChI=1S/C8H5N3O5S/c1-16-8(13)5-4(11(14)15)3-6(12)9-2-10-7(3)17-5/h2H,1H3,(H,9,10,12)