methyl 2-[[4-tert-butyl-2-[(2-methoxycarbonylphenyl)sulfanylmethyl]-3-oxidanyl-phenyl]methylsulfanyl]benzoate

Systemtic Name: methyl 2-[[4-tert-butyl-2-[(2-methoxycarbonylphenyl)sulfanylmethyl]-3-oxidanyl-phenyl]methylsulfanyl]benzoate Openeye Name: methyl 2-[[4-tert-butyl-3-hydroxy-2-[(2-methoxycarbonylphenyl)sulfanylmethyl]phenyl]methylsulfanyl]benzoate CAS Name: 2-[[4-tert-butyl-3-hydroxy-2-[[(2-methoxycarbonylphenyl)thio]methyl]phenyl]methylthio]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-tert-butyl-3-hydroxy-2-[(2-methoxycarbonylphenyl)sulfanylmethyl]phenyl]methylsulfanyl]benzoate Traditional Name: 2-[[4-tert-butyl-2-[[(2-carbomethoxyphenyl)thio]methyl]-3-hydroxy-benzyl]thio]benzoic acid methyl ester Formula: C28H30O5S2 MolecularWeight: 510.6648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=C(C=C1)CSC2=CC=CC=C2C(=O)OC)CSC3=CC=CC=C3C(=O)OC)O

Isomeric SMILES

CC(C)(C)C1=C(C(=C(C=C1)CSC2=CC=CC=C2C(=O)OC)CSC3=CC=CC=C3C(=O)OC)O

InChI

InChI=1S/C28H30O5S2/c1-28(2,3)22-15-14-18(16-34-23-12-8-6-10-19(23)26(30)32-4)21(25(22)29)17-35-24-13-9-7-11-20(24)27(31)33-5/h6-15,29H,16-17H2,1-5H3