O-[2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-dimethyl-butyl] ethanethioate

Systemtic Name: O-[2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-dimethyl-butyl] ethanethioate Openeye Name: O-[2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-dimethyl-butyl] ethanethioate CAS Name: ethanethioic acid O-[2-[(4,6-dimethoxy-2-pyrimidinyl)thio]-3,3-dimethylbutyl] ester IUPAC Name: O-[2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-3,3-dimethylbutyl] ethanethioate Traditional Name: ethanethioic acid O-[2-[(4,6-dimethoxypyrimidin-2-yl)thio]-3,3-dimethyl-butyl] ester Formula: C14H22N2O3S2 MolecularWeight: 330.46608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=S)OCC(C(C)(C)C)SC1=NC(=CC(=N1)OC)OC

Isomeric SMILES

CC(=S)OCC(C(C)(C)C)SC1=NC(=CC(=N1)OC)OC

InChI

InChI=1S/C14H22N2O3S2/c1-9(20)19-8-10(14(2,3)4)21-13-15-11(17-5)7-12(16-13)18-6/h7,10H,8H2,1-6H3