S-[[2,6-bis(chloranyl)phenyl]methyl] 3,5-ditert-butyl-4-oxidanyl-benzenecarbothioate

Systemtic Name: S-[[2,6-bis(chloranyl)phenyl]methyl] 3,5-ditert-butyl-4-oxidanyl-benzenecarbothioate Openeye Name: S-[(2,6-dichlorophenyl)methyl] 3,5-ditert-butyl-4-hydroxy-benzenecarbothioate CAS Name: 3,5-ditert-butyl-4-hydroxybenzenecarbothioic acid S-[(2,6-dichlorophenyl)methyl] ester IUPAC Name: S-[(2,6-dichlorophenyl)methyl] 3,5-ditert-butyl-4-hydroxybenzenecarbothioate Traditional Name: 3,5-ditert-butyl-4-hydroxy-thiobenzoic acid S-(2,6-dichlorobenzyl) ester Formula: C22H26Cl2O2S MolecularWeight: 425.41164

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)SCC2=C(C=CC=C2Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)SCC2=C(C=CC=C2Cl)Cl

InChI

InChI=1S/C22H26Cl2O2S/c1-21(2,3)15-10-13(11-16(19(15)25)22(4,5)6)20(26)27-12-14-17(23)8-7-9-18(14)24/h7-11,25H,12H2,1-6H3