2-[(4-bromophenyl)methylsulfanyl]-1-(phenylmethyl)-5-(trifluoromethyl)benzimidazole

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-1-(phenylmethyl)-5-(trifluoromethyl)benzimidazole Openeye Name: 1-benzyl-2-[(4-bromophenyl)methylsulfanyl]-5-(trifluoromethyl)benzimidazole CAS Name: 2-[(4-bromophenyl)methylthio]-1-(phenylmethyl)-5-(trifluoromethyl)benzimidazole IUPAC Name: 1-benzyl-2-[(4-bromophenyl)methylsulfanyl]-5-(trifluoromethyl)benzimidazole Traditional Name: 1-benzyl-2-[(4-bromobenzyl)thio]-5-(trifluoromethyl)benzimidazole Formula: C22H16BrF3N2S MolecularWeight: 477.34005

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)C(F)(F)F)N=C2SCC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)C(F)(F)F)N=C2SCC4=CC=C(C=C4)Br

InChI

InChI=1S/C22H16BrF3N2S/c23-18-9-6-16(7-10-18)14-29-21-27-19-12-17(22(24,25)26)8-11-20(19)28(21)13-15-4-2-1-3-5-15/h1-12H,13-14H2