3-methylbutyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanylethanoate

Systemtic Name: 3-methylbutyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanylethanoate Openeye Name: isopentyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)thio]acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-(4,6-dimethoxypyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(4,6-dimethoxypyrimidin-2-yl)thio]acetic acid isoamyl ester Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CSC1=NC(=CC(=N1)OC)OC

Isomeric SMILES

CC(C)CCOC(=O)CSC1=NC(=CC(=N1)OC)OC

InChI

InChI=1S/C13H20N2O4S/c1-9(2)5-6-19-12(16)8-20-13-14-10(17-3)7-11(15-13)18-4/h7,9H,5-6,8H2,1-4H3