S-methyl 3-(4-methylphenyl)-2-[(4-methylphenyl)methyl]-2-(phenylsulfonyl)propanethioate

Systemtic Name: S-methyl 3-(4-methylphenyl)-2-[(4-methylphenyl)methyl]-2-(phenylsulfonyl)propanethioate Openeye Name: S-methyl 2-(benzenesulfonyl)-3-(p-tolyl)-2-(p-tolylmethyl)propanethioate CAS Name: 2-(benzenesulfonyl)-3-(4-methylphenyl)-2-[(4-methylphenyl)methyl]propanethioic acid S-methyl ester IUPAC Name: S-methyl 2-(benzenesulfonyl)-3-(4-methylphenyl)-2-[(4-methylphenyl)methyl]propanethioate Traditional Name: 2-besyl-2-(4-methylbenzyl)-3-(p-tolyl)propanethioic acid S-methyl ester Formula: C25H26O3S2 MolecularWeight: 438.60214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(CC2=CC=C(C=C2)C)(C(=O)SC)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CC(CC2=CC=C(C=C2)C)(C(=O)SC)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H26O3S2/c1-19-9-13-21(14-10-19)17-25(24(26)29-3,18-22-15-11-20(2)12-16-22)30(27,28)23-7-5-4-6-8-23/h4-16H,17-18H2,1-3H3