(5-methyl-2-propan-2-yl-cyclohexyl) 2-(4-methylphenyl)sulfanylethanoate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 2-(4-methylphenyl)sulfanylethanoate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 2-(p-tolylsulfanyl)acetate CAS Name: 2-[(4-methylphenyl)thio]acetic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 2-(4-methylphenyl)sulfanylacetate Traditional Name: 2-(p-tolylthio)acetic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C19H28O2S MolecularWeight: 320.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)CSC2=CC=C(C=C2)C)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)CSC2=CC=C(C=C2)C)C(C)C

InChI

InChI=1S/C19H28O2S/c1-13(2)17-10-7-15(4)11-18(17)21-19(20)12-22-16-8-5-14(3)6-9-16/h5-6,8-9,13,15,17-18H,7,10-12H2,1-4H3