4-methyl-2-(5-methyl-2-oxidanyl-3-propan-2-yl-phenyl)sulfanyl-6-propan-2-yl-phenol; titanium(2+); dichloride

Systemtic Name: 4-methyl-2-(5-methyl-2-oxidanyl-3-propan-2-yl-phenyl)sulfanyl-6-propan-2-yl-phenol; titanium(2+); dichloride Openeye Name: 2-(2-hydroxy-3-isopropyl-5-methyl-phenyl)sulfanyl-6-isopropyl-4-methyl-phenol; titanium(2+); dichloride CAS Name: 2-[(2-hydroxy-5-methyl-3-propan-2-ylphenyl)thio]-4-methyl-6-propan-2-ylphenol; titanium(2+); dichloride IUPAC Name: 2-(2-hydroxy-5-methyl-3-propan-2-ylphenyl)sulfanyl-4-methyl-6-propan-2-ylphenol; titanium(2+); dichloride Traditional Name: 2-[(2-hydroxy-3-isopropyl-5-methyl-phenyl)thio]-6-isopropyl-4-methyl-phenol; titanium(2+); dichloride Formula: C20H26Cl2O2STi MolecularWeight: 449.25724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)SC2=CC(=CC(=C2O)C(C)C)C)O)C(C)C.[Cl-].[Cl-].[Ti+2]

Isomeric SMILES

CC1=CC(=C(C(=C1)SC2=CC(=CC(=C2O)C(C)C)C)O)C(C)C.[Cl-].[Cl-].[Ti+2]

InChI

InChI=1S/C20H26O2S.2ClH.Ti/c1-11(2)15-7-13(5)9-17(19(15)21)23-18-10-14(6)8-16(12(3)4)20(18)22;;;/h7-12,21-22H,1-6H3;2*1H;/q;;;+2/p-2