3-[[(4-hydroxyphenyl)amino]methyl]-3H-1,3-benzothiazol-3-ium-2-thione chloride

Systemtic Name: 3-[[(4-hydroxyphenyl)amino]methyl]-3H-1,3-benzothiazol-3-ium-2-thione chloride Openeye Name: 3-[(4-hydroxyanilino)methyl]-3H-1,3-benzothiazol-3-ium-2-thione chloride CAS Name: 3-[(4-hydroxyanilino)methyl]-3H-1,3-benzothiazol-3-ium-2-thione chloride IUPAC Name: 3-[(4-hydroxyanilino)methyl]-3H-1,3-benzothiazol-3-ium-2-thione chloride Traditional Name: 3-[(4-hydroxyanilino)methyl]-3H-1,3-benzothiazol-3-ium-2-thione chloride Formula: C14H13ClN2OS2 MolecularWeight: 324.84882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[NH+](C(=S)S2)CNC3=CC=C(C=C3)O.[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)[NH+](C(=S)S2)CNC3=CC=C(C=C3)O.[Cl-]

InChI

InChI=1S/C14H12N2OS2.ClH/c17-11-7-5-10(6-8-11)15-9-16-12-3-1-2-4-13(12)19-14(16)18;/h1-8,15,17H,9H2;1H