S-phenethyl 3,5-ditert-butyl-4-oxidanyl-benzenecarbothioate

Systemtic Name: S-phenethyl 3,5-ditert-butyl-4-oxidanyl-benzenecarbothioate Openeye Name: S-phenethyl 3,5-ditert-butyl-4-hydroxy-benzenecarbothioate CAS Name: 3,5-ditert-butyl-4-hydroxybenzenecarbothioic acid S-phenethyl ester IUPAC Name: S-phenethyl 3,5-ditert-butyl-4-hydroxybenzenecarbothioate Traditional Name: 3,5-ditert-butyl-4-hydroxy-thiobenzoic acid S-phenethyl ester Formula: C23H30O2S MolecularWeight: 370.5481

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)SCCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)SCCC2=CC=CC=C2

InChI

InChI=1S/C23H30O2S/c1-22(2,3)18-14-17(15-19(20(18)24)23(4,5)6)21(25)26-13-12-16-10-8-7-9-11-16/h7-11,14-15,24H,12-13H2,1-6H3