S-methyl 2-[4-(2-methylpropyl)phenyl]propanethioate

Systemtic Name: S-methyl 2-[4-(2-methylpropyl)phenyl]propanethioate Openeye Name: S-methyl 2-(4-isobutylphenyl)propanethioate CAS Name: 2-[4-(2-methylpropyl)phenyl]propanethioic acid S-methyl ester IUPAC Name: S-methyl 2-[4-(2-methylpropyl)phenyl]propanethioate Traditional Name: 2-(4-isobutylphenyl)propanethioic acid S-methyl ester Formula: C14H20OS MolecularWeight: 236.373

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)C(=O)SC

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C)C(=O)SC

InChI

InChI=1S/C14H20OS/c1-10(2)9-12-5-7-13(8-6-12)11(3)14(15)16-4/h5-8,10-11H,9H2,1-4H3