ethyl 4-[1-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-1-(1,3-oxazol-4-yl)-2-phenyl-ethyl]-2-methyl-benzenesulfonate

Systemtic Name: ethyl 4-[1-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-1-(1,3-oxazol-4-yl)-2-phenyl-ethyl]-2-methyl-benzenesulfonate Openeye Name: ethyl 4-[1-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-1-oxazol-4-yl-2-phenyl-ethyl]-2-methyl-benzenesulfonate CAS Name: 4-[1-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-1-(4-oxazolyl)-2-phenylethyl]-2-methylbenzenesulfonic acid ethyl ester IUPAC Name: ethyl 4-[1-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl-1-(1,3-oxazol-4-yl)-2-phenylethyl]-2-methylbenzenesulfonate Traditional Name: 4-[1-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]-1-oxazol-4-yl-2-phenyl-ethyl]-2-methyl-benzenesulfonic acid ethyl ester Formula: C34H41NO5S2 MolecularWeight: 607.82304

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)C1=C(C=C(C=C1)C(CC2=CC=CC=C2)(C3=COC=N3)SC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C)C

Isomeric SMILES

CCOS(=O)(=O)C1=C(C=C(C=C1)C(CC2=CC=CC=C2)(C3=COC=N3)SC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C)C

InChI

InChI=1S/C34H41NO5S2/c1-9-40-42(37,38)29-16-15-25(17-23(29)2)34(30-21-39-22-35-30,20-24-13-11-10-12-14-24)41-26-18-27(32(3,4)5)31(36)28(19-26)33(6,7)8/h10-19,21-22,36H,9,20H2,1-8H3