2-methylpropyl 2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylethanoate

Systemtic Name: 2-methylpropyl 2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylethanoate Openeye Name: isobutyl 2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylacetate CAS Name: 2-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-(2-methyl-6-phenylpyrimidin-4-yl)sulfanylacetate Traditional Name: 2-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]acetic acid isobutyl ester Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)SCC(=O)OCC(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=NC(=CC(=N1)SCC(=O)OCC(C)C)C2=CC=CC=C2

InChI

InChI=1S/C17H20N2O2S/c1-12(2)10-21-17(20)11-22-16-9-15(18-13(3)19-16)14-7-5-4-6-8-14/h4-9,12H,10-11H2,1-3H3