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

Systemtic Name: cyclohexyl 2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylethanoate Openeye Name: cyclohexyl 2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanylacetate CAS Name: 2-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-(2-methyl-6-phenylpyrimidin-4-yl)sulfanylacetate Traditional Name: 2-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]acetic acid cyclohexyl ester Formula: C19H22N2O2S MolecularWeight: 342.45518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)SCC(=O)OC2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC(=N1)SCC(=O)OC2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C19H22N2O2S/c1-14-20-17(15-8-4-2-5-9-15)12-18(21-14)24-13-19(22)23-16-10-6-3-7-11-16/h2,4-5,8-9,12,16H,3,6-7,10-11,13H2,1H3