2-[5-(3,4-dimethoxyphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]butanoate

Systemtic Name: 2-[5-(3,4-dimethoxyphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]butanoate Openeye Name: 2-[5-(3,4-dimethoxyphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]butanoate CAS Name: 2-[5-(3,4-dimethoxyphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]butanoate IUPAC Name: 2-[5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]butanoate Traditional Name: 2-[5-(3,4-dimethoxyphenyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]butyrate Formula: C18H17N2O5S- MolecularWeight: 373.40298

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])N1C=NC2=C(C1=O)C(=CS2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC(C(=O)[O-])N1C=NC2=C(C1=O)C(=CS2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C18H18N2O5S/c1-4-12(18(22)23)20-9-19-16-15(17(20)21)11(8-26-16)10-5-6-13(24-2)14(7-10)25-3/h5-9,12H,4H2,1-3H3,(H,22,23)/p-1