4-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-2-propylsulfanyl-1,3-thiazol-5-one

Systemtic Name: 4-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-2-propylsulfanyl-1,3-thiazol-5-one Openeye Name: 4-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]-2-propylsulfanyl-thiazol-5-one CAS Name: 4-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-2-(propylthio)-5-thiazolone IUPAC Name: 4-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-2-propylsulfanyl-1,3-thiazol-5-one Traditional Name: 4-(3,5-ditert-butyl-4-hydroxy-benzylidene)-2-(propylthio)-2-thiazolin-5-one Formula: C21H29NO2S2 MolecularWeight: 391.59046

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)S1

Isomeric SMILES

CCCSC1=NC(=CC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)S1

InChI

InChI=1S/C21H29NO2S2/c1-8-9-25-19-22-16(18(24)26-19)12-13-10-14(20(2,3)4)17(23)15(11-13)21(5,6)7/h10-12,23H,8-9H2,1-7H3