2-[5-(3,4-dimethoxyphenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoic acid

Systemtic Name: 2-[5-(3,4-dimethoxyphenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoic acid Openeye Name: 2-[5-(3,4-dimethoxyphenyl)-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoic acid CAS Name: 2-[5-(3,4-dimethoxyphenyl)-6-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoic acid IUPAC Name: 2-[5-(3,4-dimethoxyphenyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoic acid Traditional Name: 2-[5-(3,4-dimethoxyphenyl)-4-keto-6-methyl-thieno[2,3-d]pyrimidin-3-yl]propionic acid Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN(C2=O)C(C)C(=O)O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)C(C)C(=O)O)C3=CC(=C(C=C3)OC)OC

InChI

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