(3-methyl-5-propan-2-yl-phenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate

Systemtic Name: (3-methyl-5-propan-2-yl-phenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Openeye Name: (3-isopropyl-5-methyl-phenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate CAS Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid (3-methyl-5-propan-2-ylphenyl) ester IUPAC Name: (3-methyl-5-propan-2-ylphenyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid (3-isopropyl-5-methyl-phenyl) ester Formula: C24H23ClO2S MolecularWeight: 410.95622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl)C(C)C

InChI

InChI=1S/C24H23ClO2S/c1-16(2)20-12-17(3)13-22(14-20)27-24(26)19-6-4-18(5-7-19)15-28-23-10-8-21(25)9-11-23/h4-14,16H,15H2,1-3H3