2-(1H-benzimidazol-2-ylsulfanylmethyl)benzenecarbonitrile bromide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)benzenecarbonitrile bromide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)benzonitrile bromide CAS Name: 2-[(1H-benzimidazol-2-ylthio)methyl]benzonitrile bromide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)benzonitrile bromide Traditional Name: 2-[(1H-benzimidazol-2-ylthio)methyl]benzonitrile bromide Formula: C15H11BrN3S- MolecularWeight: 345.23694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3N2)C#N.[Br-]

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC3=CC=CC=C3N2)C#N.[Br-]

InChI

InChI=1S/C15H11N3S.BrH/c16-9-11-5-1-2-6-12(11)10-19-15-17-13-7-3-4-8-14(13)18-15;/h1-8H,10H2,(H,17,18);1H/p-1