2-[(6-bromanyl-1H-benzimidazol-2-yl)sulfanylmethyl]-1-(phenylmethyl)benzimidazole

Systemtic Name: 2-[(6-bromanyl-1H-benzimidazol-2-yl)sulfanylmethyl]-1-(phenylmethyl)benzimidazole Openeye Name: 1-benzyl-2-[(6-bromo-1H-benzimidazol-2-yl)sulfanylmethyl]benzimidazole CAS Name: 2-[[(6-bromo-1H-benzimidazol-2-yl)thio]methyl]-1-(phenylmethyl)benzimidazole IUPAC Name: 1-benzyl-2-[(6-bromo-1H-benzimidazol-2-yl)sulfanylmethyl]benzimidazole Traditional Name: 1-benzyl-2-[[(6-bromo-1H-benzimidazol-2-yl)thio]methyl]benzimidazole Formula: C22H17BrN4S MolecularWeight: 449.36618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2CSC4=NC5=C(N4)C=C(C=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2CSC4=NC5=C(N4)C=C(C=C5)Br

InChI

InChI=1S/C22H17BrN4S/c23-16-10-11-17-19(12-16)26-22(25-17)28-14-21-24-18-8-4-5-9-20(18)27(21)13-15-6-2-1-3-7-15/h1-12H,13-14H2,(H,25,26)