2-[(6-ethoxycarbonyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfonyl]ethanoate

Systemtic Name: 2-[(6-ethoxycarbonyl-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfonyl]ethanoate Openeye Name: 2-[(6-ethoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfonyl]acetate CAS Name: 2-[(6-ethoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfonyl]acetate IUPAC Name: 2-[(6-ethoxycarbonyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfonyl]acetate Traditional Name: 2-[(6-carbethoxy-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfonyl]acetate Formula: C13H13N2O7S2- MolecularWeight: 373.38152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)CS(=O)(=O)CC(=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)CS(=O)(=O)CC(=O)[O-])C

InChI

InChI=1S/C13H14N2O7S2/c1-3-22-13(19)10-6(2)9-11(18)14-7(15-12(9)23-10)4-24(20,21)5-8(16)17/h3-5H2,1-2H3,(H,16,17)(H,14,15,18)/p-1