5-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-2-(4-fluorophenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one

Systemtic Name: 5-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylidene]-2-(4-fluorophenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one Openeye Name: 5-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylene]-2-(4-fluorophenyl)thiazolo[3,2-b][1,2,4]triazol-6-one CAS Name: 5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-2-(4-fluorophenyl)-6-thiazolo[3,2-b][1,2,4]triazolone IUPAC Name: 5-[(3,5-ditert-butyl-4-hydroxyphenyl)methylidene]-2-(4-fluorophenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one Traditional Name: 5-(3,5-ditert-butyl-4-hydroxy-benzylidene)-2-(4-fluorophenyl)thiazolo[3,2-b][1,2,4]triazol-6-one Formula: C25H26FN3O2S MolecularWeight: 451.556243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)F)S2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)F)S2

InChI

InChI=1S/C25H26FN3O2S/c1-24(2,3)17-11-14(12-18(20(17)30)25(4,5)6)13-19-22(31)29-23(32-19)27-21(28-29)15-7-9-16(26)10-8-15/h7-13,30H,1-6H3