1-methyl-2-(3-nitrothiophen-2-yl)-5,6-bis(oxidanylidene)-4H-pyrimidine-4-carboxylic acid

Systemtic Name: 1-methyl-2-(3-nitrothiophen-2-yl)-5,6-bis(oxidanylidene)-4H-pyrimidine-4-carboxylic acid Openeye Name: 1-methyl-2-(3-nitro-2-thienyl)-5,6-dioxo-4H-pyrimidine-4-carboxylic acid CAS Name: 1-methyl-2-(3-nitro-2-thiophenyl)-5,6-dioxo-4H-pyrimidine-4-carboxylic acid IUPAC Name: 1-methyl-2-(3-nitrothiophen-2-yl)-5,6-dioxo-4H-pyrimidine-4-carboxylic acid Traditional Name: 5,6-diketo-1-methyl-2-(3-nitro-2-thienyl)-4H-pyrimidine-4-carboxylic acid Formula: C10H7N3O6S MolecularWeight: 297.24408

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(C(=O)C1=O)C(=O)O)C2=C(C=CS2)[N+](=O)[O-]

Isomeric SMILES

CN1C(=NC(C(=O)C1=O)C(=O)O)C2=C(C=CS2)[N+](=O)[O-]

InChI

InChI=1S/C10H7N3O6S/c1-12-8(7-4(13(18)19)2-3-20-7)11-5(10(16)17)6(14)9(12)15/h2-3,5H,1H3,(H,16,17)