bis(chloranyl)titanium; 3-tert-butyl-5-methyl-2-(2,3,4,5-tetramethylcyclopentyl)sulfanyl-phenol

Systemtic Name: bis(chloranyl)titanium; 3-tert-butyl-5-methyl-2-(2,3,4,5-tetramethylcyclopentyl)sulfanyl-phenol Openeye Name: 3-tert-butyl-5-methyl-2-(2,3,4,5-tetramethylcyclopentyl)sulfanyl-phenol; dichlorotitanium CAS Name: 3-tert-butyl-5-methyl-2-[(2,3,4,5-tetramethylcyclopentyl)thio]phenol; dichlorotitanium IUPAC Name: 3-tert-butyl-5-methyl-2-(2,3,4,5-tetramethylcyclopentyl)sulfanylphenol; dichlorotitanium Traditional Name: 3-tert-butyl-5-methyl-2-[(2,3,4,5-tetramethylcyclopentyl)thio]phenol; dichlorotitanium Formula: C20H27Cl2OSTi MolecularWeight: 434.26578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)O)S[C]2[C]([C]([C]([C]2C)C)C)C)C(C)(C)C.Cl[Ti]Cl

Isomeric SMILES

CC1=CC(=C(C(=C1)O)S[C]2[C]([C]([C]([C]2C)C)C)C)C(C)(C)C.Cl[Ti]Cl

InChI

InChI=1S/C20H27OS.2ClH.Ti/c1-11-9-16(20(6,7)8)19(17(21)10-11)22-18-14(4)12(2)13(3)15(18)5;;;/h9-10,21H,1-8H3;2*1H;/q;;;+2/p-2