(1-butylsulfonyl-3-methoxy-propan-2-yl) 2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoate

Systemtic Name: (1-butylsulfonyl-3-methoxy-propan-2-yl) 2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoate Openeye Name: [1-(butylsulfonylmethyl)-2-methoxy-ethyl] 2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetic acid (1-butylsulfonyl-3-methoxypropan-2-yl) ester IUPAC Name: (1-butylsulfonyl-3-methoxypropan-2-yl) 2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]acetic acid [1-(butylsulfonylmethyl)-2-methoxy-ethyl] ester Formula: C16H26N2O5S2 MolecularWeight: 390.51804

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)CC(COC)OC(=O)CSC1=NC(=CC(=N1)C)C

Isomeric SMILES

CCCCS(=O)(=O)CC(COC)OC(=O)CSC1=NC(=CC(=N1)C)C

InChI

InChI=1S/C16H26N2O5S2/c1-5-6-7-25(20,21)11-14(9-22-4)23-15(19)10-24-16-17-12(2)8-13(3)18-16/h8,14H,5-7,9-11H2,1-4H3