S-(3-phenylpropyl) 3,5-ditert-butyl-4-oxidanyl-benzenecarbothioate

Systemtic Name: S-(3-phenylpropyl) 3,5-ditert-butyl-4-oxidanyl-benzenecarbothioate Openeye Name: S-(3-phenylpropyl) 3,5-ditert-butyl-4-hydroxy-benzenecarbothioate CAS Name: 3,5-ditert-butyl-4-hydroxybenzenecarbothioic acid S-(3-phenylpropyl) ester IUPAC Name: S-(3-phenylpropyl) 3,5-ditert-butyl-4-hydroxybenzenecarbothioate Traditional Name: 3,5-ditert-butyl-4-hydroxy-thiobenzoic acid S-(3-phenylpropyl) ester Formula: C24H32O2S MolecularWeight: 384.57468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)SCCCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)SCCCC2=CC=CC=C2

InChI

InChI=1S/C24H32O2S/c1-23(2,3)19-15-18(16-20(21(19)25)24(4,5)6)22(26)27-14-10-13-17-11-8-7-9-12-17/h7-9,11-12,15-16,25H,10,13-14H2,1-6H3