methyl 4-[2-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoyloxymethyl]benzoate

Systemtic Name: methyl 4-[2-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoyloxymethyl]benzoate Openeye Name: methyl 4-[[2-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)acetyl]oxymethyl]benzoate CAS Name: 4-[[2-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-1-oxoethoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]oxymethyl]benzoate Traditional Name: 4-[[2-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]oxymethyl]benzoic acid methyl ester Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)OCC3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)OCC3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C19H18N2O5S/c1-11-12(2)27-17-16(11)18(23)21(10-20-17)8-15(22)26-9-13-4-6-14(7-5-13)19(24)25-3/h4-7,10H,8-9H2,1-3H3