methyl 2-[[2-(4,6-dimethoxypyrimidin-2-yl)-1-benzothiophen-3-yl]oxy]ethanoate

Systemtic Name: methyl 2-[[2-(4,6-dimethoxypyrimidin-2-yl)-1-benzothiophen-3-yl]oxy]ethanoate Openeye Name: methyl 2-[2-(4,6-dimethoxypyrimidin-2-yl)benzothiophen-3-yl]oxyacetate CAS Name: 2-[[2-(4,6-dimethoxy-2-pyrimidinyl)-1-benzothiophen-3-yl]oxy]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(4,6-dimethoxypyrimidin-2-yl)-1-benzothiophen-3-yl]oxy]acetate Traditional Name: 2-[2-(4,6-dimethoxypyrimidin-2-yl)benzothiophen-3-yl]oxyacetic acid methyl ester Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)C2=C(C3=CC=CC=C3S2)OCC(=O)OC)OC

Isomeric SMILES

COC1=CC(=NC(=N1)C2=C(C3=CC=CC=C3S2)OCC(=O)OC)OC

InChI

InChI=1S/C17H16N2O5S/c1-21-12-8-13(22-2)19-17(18-12)16-15(24-9-14(20)23-3)10-6-4-5-7-11(10)25-16/h4-8H,9H2,1-3H3