2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-4-hex-2-ynyl-thiomorpholin-3-one

Systemtic Name: 2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-4-hex-2-ynyl-thiomorpholin-3-one Openeye Name: 2-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]-4-hex-2-ynyl-thiomorpholin-3-one CAS Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-4-hex-2-ynyl-3-thiomorpholinone IUPAC Name: 2-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-4-hex-2-ynylthiomorpholin-3-one Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-benzyl)-4-hex-2-ynyl-thiomorpholin-3-one Formula: C25H37NO2S MolecularWeight: 415.63178

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CCN1CCSC(C1=O)CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCC#CCN1CCSC(C1=O)CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C25H37NO2S/c1-8-9-10-11-12-26-13-14-29-21(23(26)28)17-18-15-19(24(2,3)4)22(27)20(16-18)25(5,6)7/h15-16,21,27H,8-9,12-14,17H2,1-7H3