methyl 3-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoyloxymethyl)benzoate

Systemtic Name: methyl 3-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoyloxymethyl)benzoate Openeye Name: methyl 3-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)oxymethyl]benzoate CAS Name: 3-[[1-oxo-2-(4-thieno[2,3-d]pyrimidinylthio)ethoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)oxymethyl]benzoate Traditional Name: 3-[[2-(thieno[2,3-d]pyrimidin-4-ylthio)acetyl]oxymethyl]benzoic acid methyl ester Formula: C17H14N2O4S2 MolecularWeight: 374.43406

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC(=O)CSC2=NC=NC3=C2C=CS3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC(=O)CSC2=NC=NC3=C2C=CS3

InChI

InChI=1S/C17H14N2O4S2/c1-22-17(21)12-4-2-3-11(7-12)8-23-14(20)9-25-16-13-5-6-24-15(13)18-10-19-16/h2-7,10H,8-9H2,1H3