2,6-ditert-butyl-4-(4-phenylphthalazin-1-yl)sulfanyl-phenol

Systemtic Name: 2,6-ditert-butyl-4-(4-phenylphthalazin-1-yl)sulfanyl-phenol Openeye Name: 2,6-ditert-butyl-4-(4-phenylphthalazin-1-yl)sulfanyl-phenol CAS Name: 2,6-ditert-butyl-4-[(4-phenyl-1-phthalazinyl)thio]phenol IUPAC Name: 2,6-ditert-butyl-4-(4-phenylphthalazin-1-yl)sulfanylphenol Traditional Name: 2,6-ditert-butyl-4-[(4-phenylphthalazin-1-yl)thio]phenol Formula: C28H30N2OS MolecularWeight: 442.6156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C28H30N2OS/c1-27(2,3)22-16-19(17-23(25(22)31)28(4,5)6)32-26-21-15-11-10-14-20(21)24(29-30-26)18-12-8-7-9-13-18/h7-17,31H,1-6H3