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

Systemtic Name: 3-(6-ethoxycarbonyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: 3-(6-ethoxycarbonyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(6-ethoxycarbonyl-5-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoate IUPAC Name: 3-(6-ethoxycarbonyl-5-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(6-carbethoxy-4-keto-5-methyl-thieno[2,3-d]pyrimidin-3-yl)propionate Formula: C13H13N2O5S- MolecularWeight: 309.31772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CCC(=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CCC(=O)[O-])C

InChI

InChI=1S/C13H14N2O5S/c1-3-20-13(19)10-7(2)9-11(21-10)14-6-15(12(9)18)5-4-8(16)17/h6H,3-5H2,1-2H3,(H,16,17)/p-1