2,3-bis(butylsulfonyl)propyl 2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoate

Systemtic Name: 2,3-bis(butylsulfonyl)propyl 2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoate Openeye Name: 2,3-bis(butylsulfonyl)propyl 2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetic acid 2,3-bis(butylsulfonyl)propyl ester IUPAC Name: 2,3-bis(butylsulfonyl)propyl 2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]acetic acid 2,3-bis(butylsulfonyl)propyl ester Formula: C19H32N2O6S3 MolecularWeight: 480.66218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)CC(COC(=O)CSC1=NC(=CC(=N1)C)C)S(=O)(=O)CCCC

Isomeric SMILES

CCCCS(=O)(=O)CC(COC(=O)CSC1=NC(=CC(=N1)C)C)S(=O)(=O)CCCC

InChI

InChI=1S/C19H32N2O6S3/c1-5-7-9-29(23,24)14-17(30(25,26)10-8-6-2)12-27-18(22)13-28-19-20-15(3)11-16(4)21-19/h11,17H,5-10,12-14H2,1-4H3