diethyl 5-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxybenzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxybenzene-1,3-dicarboxylate Openeye Name: diethyl 5-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxybenzene-1,3-dicarboxylate CAS Name: 5-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)oxy]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxybenzene-1,3-dicarboxylate Traditional Name: 5-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxybenzene-1,3-dicarboxylic acid diethyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)OC2=C3C(=C(SC3=NC=N2)C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)OC2=C3C(=C(SC3=NC=N2)C)C)C(=O)OCC

InChI

InChI=1S/C20H20N2O5S/c1-5-25-19(23)13-7-14(20(24)26-6-2)9-15(8-13)27-17-16-11(3)12(4)28-18(16)22-10-21-17/h7-10H,5-6H2,1-4H3