1-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-(2-sulfanylidene-1,3-benzothiazol-3-yl)ethanone

Systemtic Name: 1-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-(2-sulfanylidene-1,3-benzothiazol-3-yl)ethanone Openeye Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(2-thioxo-1,3-benzothiazol-3-yl)ethanone CAS Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(2-sulfanylidene-1,3-benzothiazol-3-yl)ethanone IUPAC Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(2-sulfanylidene-1,3-benzothiazol-3-yl)ethanone Traditional Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-(2-thioxo-1,3-benzothiazol-3-yl)ethanone Formula: C23H27NO2S2 MolecularWeight: 413.59598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CN2C3=CC=CC=C3SC2=S

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)CN2C3=CC=CC=C3SC2=S

InChI

InChI=1S/C23H27NO2S2/c1-22(2,3)15-11-14(12-16(20(15)26)23(4,5)6)18(25)13-24-17-9-7-8-10-19(17)28-21(24)27/h7-12,26H,13H2,1-6H3