N-[6-(3,5-ditert-butyl-4-oxidanyl-phenyl)hexyl]-2-[2-oxidanylidene-4-(phenylmethyl)sulfinyl-azetidin-1-yl]ethanamide

Systemtic Name: N-[6-(3,5-ditert-butyl-4-oxidanyl-phenyl)hexyl]-2-[2-oxidanylidene-4-(phenylmethyl)sulfinyl-azetidin-1-yl]ethanamide Openeye Name: 2-(2-benzylsulfinyl-4-oxo-azetidin-1-yl)-N-[6-(3,5-ditert-butyl-4-hydroxy-phenyl)hexyl]acetamide CAS Name: N-[6-(3,5-ditert-butyl-4-hydroxyphenyl)hexyl]-2-[2-oxo-4-(phenylmethyl)sulfinyl-1-azetidinyl]acetamide IUPAC Name: 2-(2-benzylsulfinyl-4-oxoazetidin-1-yl)-N-[6-(3,5-ditert-butyl-4-hydroxyphenyl)hexyl]acetamide Traditional Name: 2-(2-benzylsulfinyl-4-keto-azetidin-1-yl)-N-[6-(3,5-ditert-butyl-4-hydroxy-phenyl)hexyl]acetamide Formula: C32H46N2O4S MolecularWeight: 554.78364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCCCCNC(=O)CN2C(CC2=O)S(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCCCCCNC(=O)CN2C(CC2=O)S(=O)CC3=CC=CC=C3

InChI

InChI=1S/C32H46N2O4S/c1-31(2,3)25-18-24(19-26(30(25)37)32(4,5)6)16-10-7-8-13-17-33-27(35)21-34-28(36)20-29(34)39(38)22-23-14-11-9-12-15-23/h9,11-12,14-15,18-19,29,37H,7-8,10,13,16-17,20-22H2,1-6H3,(H,33,35)