2-[(4-bromanyl-2,3,5,6-tetramethyl-phenyl)methylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[(4-bromanyl-2,3,5,6-tetramethyl-phenyl)methylsulfanyl]-1H-benzimidazole Openeye Name: 2-[(4-bromo-2,3,5,6-tetramethyl-phenyl)methylsulfanyl]-1H-benzimidazole CAS Name: 2-[(4-bromo-2,3,5,6-tetramethylphenyl)methylthio]-1H-benzimidazole IUPAC Name: 2-[(4-bromo-2,3,5,6-tetramethylphenyl)methylsulfanyl]-1H-benzimidazole Traditional Name: 2-[(4-bromo-2,3,5,6-tetramethyl-benzyl)thio]-1H-benzimidazole Formula: C18H19BrN2S MolecularWeight: 375.32586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1CSC2=NC3=CC=CC=C3N2)C)C)Br)C

Isomeric SMILES

CC1=C(C(=C(C(=C1CSC2=NC3=CC=CC=C3N2)C)C)Br)C

InChI

InChI=1S/C18H19BrN2S/c1-10-12(3)17(19)13(4)11(2)14(10)9-22-18-20-15-7-5-6-8-16(15)21-18/h5-8H,9H2,1-4H3,(H,20,21)