methyl 2-[bis(phenylsulfanyl)methyl]-4,6-dimethoxy-benzoate

Systemtic Name: methyl 2-[bis(phenylsulfanyl)methyl]-4,6-dimethoxy-benzoate Openeye Name: methyl 2-[bis(phenylsulfanyl)methyl]-4,6-dimethoxy-benzoate CAS Name: 2-[bis(phenylthio)methyl]-4,6-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[bis(phenylsulfanyl)methyl]-4,6-dimethoxybenzoate Traditional Name: 2-[bis(phenylthio)methyl]-4,6-dimethoxy-benzoic acid methyl ester Formula: C23H22O4S2 MolecularWeight: 426.54838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)C(SC2=CC=CC=C2)SC3=CC=CC=C3)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)C(SC2=CC=CC=C2)SC3=CC=CC=C3)C(=O)OC)OC

InChI

InChI=1S/C23H22O4S2/c1-25-16-14-19(21(22(24)27-3)20(15-16)26-2)23(28-17-10-6-4-7-11-17)29-18-12-8-5-9-13-18/h4-15,23H,1-3H3