2-[(4-bromanyl-2,5-dimethoxy-phenyl)methylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[(4-bromanyl-2,5-dimethoxy-phenyl)methylsulfanyl]-1H-benzimidazole Openeye Name: 2-[(4-bromo-2,5-dimethoxy-phenyl)methylsulfanyl]-1H-benzimidazole CAS Name: 2-[(4-bromo-2,5-dimethoxyphenyl)methylthio]-1H-benzimidazole IUPAC Name: 2-[(4-bromo-2,5-dimethoxyphenyl)methylsulfanyl]-1H-benzimidazole Traditional Name: 2-[(4-bromo-2,5-dimethoxy-benzyl)thio]-1H-benzimidazole Formula: C16H15BrN2O2S MolecularWeight: 379.2715

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CSC2=NC3=CC=CC=C3N2)OC)Br

Isomeric SMILES

COC1=CC(=C(C=C1CSC2=NC3=CC=CC=C3N2)OC)Br

InChI

InChI=1S/C16H15BrN2O2S/c1-20-14-8-11(17)15(21-2)7-10(14)9-22-16-18-12-5-3-4-6-13(12)19-16/h3-8H,9H2,1-2H3,(H,18,19)