bis(phenylmethyl) 2-[(phenylmethylsulfanyl)methyl]pentanedioate

Systemtic Name: bis(phenylmethyl) 2-[(phenylmethylsulfanyl)methyl]pentanedioate Openeye Name: dibenzyl 2-(benzylsulfanylmethyl)pentanedioate CAS Name: 2-[(phenylmethylthio)methyl]pentanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-(benzylsulfanylmethyl)pentanedioate Traditional Name: 2-[(benzylthio)methyl]glutaric acid dibenzyl ester Formula: C27H28O4S MolecularWeight: 448.57382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCC(CSCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCC(CSCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H28O4S/c28-26(30-18-22-10-4-1-5-11-22)17-16-25(21-32-20-24-14-8-3-9-15-24)27(29)31-19-23-12-6-2-7-13-23/h1-15,25H,16-21H2