3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-1-pyrrolidin-1-yl-butan-1-one

Systemtic Name: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)sulfanyl-1-pyrrolidin-1-yl-butan-1-one Openeye Name: 3-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-1-pyrrolidin-1-yl-butan-1-one CAS Name: 3-[(3,5-ditert-butyl-4-hydroxyphenyl)thio]-1-(1-pyrrolidinyl)-1-butanone IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanyl-1-pyrrolidin-1-ylbutan-1-one Traditional Name: 3-[(3,5-ditert-butyl-4-hydroxy-phenyl)thio]-1-pyrrolidino-butan-1-one Formula: C22H35NO2S MolecularWeight: 377.5838

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCCC1)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC(CC(=O)N1CCCC1)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C22H35NO2S/c1-15(12-19(24)23-10-8-9-11-23)26-16-13-17(21(2,3)4)20(25)18(14-16)22(5,6)7/h13-15,25H,8-12H2,1-7H3