3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-5-(2-dodecylsulfanylethyl)-1,3,4-oxadiazol-2-one

Systemtic Name: 3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-5-(2-dodecylsulfanylethyl)-1,3,4-oxadiazol-2-one Openeye Name: 3-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]-5-(2-dodecylsulfanylethyl)-1,3,4-oxadiazol-2-one CAS Name: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-5-[2-(dodecylthio)ethyl]-1,3,4-oxadiazol-2-one IUPAC Name: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-5-(2-dodecylsulfanylethyl)-1,3,4-oxadiazol-2-one Traditional Name: 3-(3,5-ditert-butyl-4-hydroxy-benzyl)-5-[2-(laurylthio)ethyl]-1,3,4-oxadiazol-2-one Formula: C31H52N2O3S MolecularWeight: 532.82118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCCC1=NN(C(=O)O1)CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCSCCC1=NN(C(=O)O1)CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C31H52N2O3S/c1-8-9-10-11-12-13-14-15-16-17-19-37-20-18-27-32-33(29(35)36-27)23-24-21-25(30(2,3)4)28(34)26(22-24)31(5,6)7/h21-22,34H,8-20,23H2,1-7H3