(4-propylsulfonylphenyl)methyl 2-(phenylmethylsulfanyl)benzoate

Systemtic Name: (4-propylsulfonylphenyl)methyl 2-(phenylmethylsulfanyl)benzoate Openeye Name: (4-propylsulfonylphenyl)methyl 2-benzylsulfanylbenzoate CAS Name: 2-(phenylmethylthio)benzoic acid (4-propylsulfonylphenyl)methyl ester IUPAC Name: (4-propylsulfonylphenyl)methyl 2-benzylsulfanylbenzoate Traditional Name: 2-(benzylthio)benzoic acid (4-propylsulfonylbenzyl) ester Formula: C24H24O4S2 MolecularWeight: 440.57496

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2SCC3=CC=CC=C3

Isomeric SMILES

CCCS(=O)(=O)C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2SCC3=CC=CC=C3

InChI

InChI=1S/C24H24O4S2/c1-2-16-30(26,27)21-14-12-19(13-15-21)17-28-24(25)22-10-6-7-11-23(22)29-18-20-8-4-3-5-9-20/h3-15H,2,16-18H2,1H3