2-[5-cyano-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethyl thiophene-2-carboxylate

Systemtic Name: 2-[5-cyano-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethyl thiophene-2-carboxylate Openeye Name: 2-(5-cyano-2,4-dioxo-pyrimidin-1-yl)ethyl thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid 2-(5-cyano-2,4-dioxo-1-pyrimidinyl)ethyl ester IUPAC Name: 2-(5-cyano-2,4-dioxopyrimidin-1-yl)ethyl thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid 2-(5-cyano-2,4-diketo-pyrimidin-1-yl)ethyl ester Formula: C12H9N3O4S MolecularWeight: 291.28256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)OCCN2C=C(C(=O)NC2=O)C#N

Isomeric SMILES

C1=CSC(=C1)C(=O)OCCN2C=C(C(=O)NC2=O)C#N

InChI

InChI=1S/C12H9N3O4S/c13-6-8-7-15(12(18)14-10(8)16)3-4-19-11(17)9-2-1-5-20-9/h1-2,5,7H,3-4H2,(H,14,16,18)