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

Systemtic Name: ethyl 5-[(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanylmethyl]-2-methyl-4-(1,3-oxazol-4-ylmethyl)benzenesulfonate Openeye Name: ethyl 5-[(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanylmethyl]-2-methyl-4-(oxazol-4-ylmethyl)benzenesulfonate CAS Name: 5-[[(3,5-ditert-butyl-4-hydroxyphenyl)thio]methyl]-2-methyl-4-(4-oxazolylmethyl)benzenesulfonic acid ethyl ester IUPAC Name: ethyl 5-[(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylmethyl]-2-methyl-4-(1,3-oxazol-4-ylmethyl)benzenesulfonate Traditional Name: 5-[[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]methyl]-2-methyl-4-(oxazol-4-ylmethyl)benzenesulfonic acid ethyl ester Formula: C28H37NO5S2 MolecularWeight: 531.72708

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)C1=C(C=C(C(=C1)CSC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)CC3=COC=N3)C

Isomeric SMILES

CCOS(=O)(=O)C1=C(C=C(C(=C1)CSC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)CC3=COC=N3)C

InChI

InChI=1S/C28H37NO5S2/c1-9-34-36(31,32)25-12-20(19(10-18(25)2)11-21-15-33-17-29-21)16-35-22-13-23(27(3,4)5)26(30)24(14-22)28(6,7)8/h10,12-15,17,30H,9,11,16H2,1-8H3