3-(phenylmethyl)-1,3-benzothiazol-3-ium-2-amine chloride

Systemtic Name: 3-(phenylmethyl)-1,3-benzothiazol-3-ium-2-amine chloride Openeye Name: 3-benzyl-1,3-benzothiazol-3-ium-2-amine chloride CAS Name: 3-(phenylmethyl)-1,3-benzothiazol-3-ium-2-amine chloride IUPAC Name: 3-benzyl-1,3-benzothiazol-3-ium-2-amine chloride Traditional Name: (3-benzyl-1,3-benzothiazol-3-ium-2-yl)amine chloride Formula: C14H13ClN2S MolecularWeight: 276.78442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(SC3=CC=CC=C32)N.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(SC3=CC=CC=C32)N.[Cl-]

InChI

InChI=1S/C14H12N2S.ClH/c15-14-16(10-11-6-2-1-3-7-11)12-8-4-5-9-13(12)17-14;/h1-9,15H,10H2;1H