2-azanylbenzenethiolate; cyclopenta-1,3-diene; titanium(4+); chloride

Systemtic Name: 2-azanylbenzenethiolate; cyclopenta-1,3-diene; titanium(4+); chloride Openeye Name: 2-aminobenzenethiolate; cyclopenta-1,3-diene; titanium(4+); chloride CAS Name: 2-aminobenzenethiolate; cyclopenta-1,3-diene; titanium(4+); chloride IUPAC Name: 2-aminobenzenethiolate; cyclopenta-1,3-diene; titanium(4+); chloride Traditional Name: 2-aminobenzenethiolate; cyclopenta-1,3-diene; titanium(4+); chloride Formula: C16H16ClNSTi MolecularWeight: 337.68994

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC=C1.[CH-]1C=CC=C1.C1=CC=C(C(=C1)N)[S-].[Cl-].[Ti+4]

Isomeric SMILES

[CH-]1C=CC=C1.[CH-]1C=CC=C1.C1=CC=C(C(=C1)N)[S-].[Cl-].[Ti+4]

InChI

InChI=1S/C6H7NS.2C5H5.ClH.Ti/c7-5-3-1-2-4-6(5)8;2*1-2-4-5-3-1;;/h1-4,8H,7H2;2*1-5H;1H;/q;2*-1;;+4/p-2