methanethiolate; 2-methylpropane; phenol; titanium(2+); dichloride

Systemtic Name: methanethiolate; 2-methylpropane; phenol; titanium(2+); dichloride Openeye Name: methanethiolate; 2-methylpropane; phenol; titanium(2+); dichloride CAS Name: methanethiolate; 2-methylpropane; phenol; titanium(2+); dichloride IUPAC Name: methanethiolate; 2-methylpropane; phenol; titanium(2+); dichloride Traditional Name: methanethiolate; 2-methylpropane; phenol; titanium(2+); dichloride Formula: C17H24Cl2O2STi-2 MolecularWeight: 411.20926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C6H6O.C4H9.CH4S.2ClH.Ti/c2*7-6-4-2-1-3-5-6;1-4(2)3;1-2;;;/h2*1-5,7H;1-3H3;2H,1H3;2*1H;/q;;-1;;;;+2/p-3