N-(3-bromanyl-4-methoxy-phenyl)-2-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propylsulfanyl]ethanamide

Systemtic Name: N-(3-bromanyl-4-methoxy-phenyl)-2-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propylsulfanyl]ethanamide Openeye Name: N-(3-bromo-4-methoxy-phenyl)-2-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propylsulfanyl]acetamide CAS Name: N-(3-bromo-4-methoxyphenyl)-2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propylthio]acetamide IUPAC Name: N-(3-bromo-4-methoxyphenyl)-2-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propylsulfanyl]acetamide Traditional Name: N-(3-bromo-4-methoxy-phenyl)-2-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propylthio]acetamide Formula: C26H36BrNO3S MolecularWeight: 522.53794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCSCC(=O)NC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCSCC(=O)NC2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C26H36BrNO3S/c1-25(2,3)19-13-17(14-20(24(19)30)26(4,5)6)9-8-12-32-16-23(29)28-18-10-11-22(31-7)21(27)15-18/h10-11,13-15,30H,8-9,12,16H2,1-7H3,(H,28,29)