2,6-ditert-butyl-4-[4-(4-methylphenyl)phthalazin-1-yl]sulfanyl-phenol

Systemtic Name: 2,6-ditert-butyl-4-[4-(4-methylphenyl)phthalazin-1-yl]sulfanyl-phenol Openeye Name: 2,6-ditert-butyl-4-[4-(p-tolyl)phthalazin-1-yl]sulfanyl-phenol CAS Name: 2,6-ditert-butyl-4-[[4-(4-methylphenyl)-1-phthalazinyl]thio]phenol IUPAC Name: 2,6-ditert-butyl-4-[4-(4-methylphenyl)phthalazin-1-yl]sulfanylphenol Traditional Name: 2,6-ditert-butyl-4-[[4-(p-tolyl)phthalazin-1-yl]thio]phenol Formula: C29H32N2OS MolecularWeight: 456.64218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C29H32N2OS/c1-18-12-14-19(15-13-18)25-21-10-8-9-11-22(21)27(31-30-25)33-20-16-23(28(2,3)4)26(32)24(17-20)29(5,6)7/h8-17,32H,1-7H3