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

Systemtic Name: 2-methylpropyl 2-[5-(3,4-dimethoxyphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: isobutyl 2-[5-(3,4-dimethoxyphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 2-[5-(3,4-dimethoxyphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[5-(3,4-dimethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: 2-[5-(3,4-dimethoxyphenyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]propionic acid isobutyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(C)N1C=NC2=C(C1=O)C(=CS2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)COC(=O)C(C)N1C=NC2=C(C1=O)C(=CS2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H24N2O5S/c1-12(2)9-28-21(25)13(3)23-11-22-19-18(20(23)24)15(10-29-19)14-6-7-16(26-4)17(8-14)27-5/h6-8,10-13H,9H2,1-5H3