ethyl 2-[[5-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1H-imidazol-2-yl]sulfanyl]propanoate

Systemtic Name: ethyl 2-[[5-(3,5-ditert-butyl-4-oxidanyl-phenyl)-1H-imidazol-2-yl]sulfanyl]propanoate Openeye Name: ethyl 2-[[5-(3,5-ditert-butyl-4-hydroxy-phenyl)-1H-imidazol-2-yl]sulfanyl]propanoate CAS Name: 2-[[5-(3,5-ditert-butyl-4-hydroxyphenyl)-1H-imidazol-2-yl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-[[5-(3,5-ditert-butyl-4-hydroxyphenyl)-1H-imidazol-2-yl]sulfanyl]propanoate Traditional Name: 2-[[5-(3,5-ditert-butyl-4-hydroxy-phenyl)-1H-imidazol-2-yl]thio]propionic acid ethyl ester Formula: C22H32N2O3S MolecularWeight: 404.56608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=NC=C(N1)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCOC(=O)C(C)SC1=NC=C(N1)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C22H32N2O3S/c1-9-27-19(26)13(2)28-20-23-12-17(24-20)14-10-15(21(3,4)5)18(25)16(11-14)22(6,7)8/h10-13,25H,9H2,1-8H3,(H,23,24)