3-[(2Z)-2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-5-oxidanylidene-thiomorpholin-4-yl]propanenitrile

Systemtic Name: 3-[(2Z)-2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-5-oxidanylidene-thiomorpholin-4-yl]propanenitrile Openeye Name: 3-[(2Z)-2-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]-5-oxo-thiomorpholin-4-yl]propanenitrile CAS Name: 3-[(2Z)-2-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-5-oxo-4-thiomorpholinyl]propanenitrile IUPAC Name: 3-[(2Z)-2-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-5-oxothiomorpholin-4-yl]propanenitrile Traditional Name: 3-[(2Z)-2-(3,5-ditert-butyl-4-hydroxy-benzylidene)-5-keto-thiomorpholin-4-yl]propionitrile Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C2CN(C(=O)CS2)CCC#N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C\2/CN(C(=O)CS2)CCC#N

InChI

InChI=1S/C22H30N2O2S/c1-21(2,3)17-11-15(12-18(20(17)26)22(4,5)6)10-16-13-24(9-7-8-23)19(25)14-27-16/h10-12,26H,7,9,13-14H2,1-6H3/b16-10-