1-[(4-bromophenyl)methylsulfanyl]-4-(phenylmethyl)-[1,2,4]triazolo[4,3-a]benzimidazole

Systemtic Name: 1-[(4-bromophenyl)methylsulfanyl]-4-(phenylmethyl)-[1,2,4]triazolo[4,3-a]benzimidazole Openeye Name: 4-benzyl-1-[(4-bromophenyl)methylsulfanyl]-[1,2,4]triazolo[4,3-a]benzimidazole CAS Name: 1-[(4-bromophenyl)methylthio]-4-(phenylmethyl)-[1,2,4]triazolo[4,3-a]benzimidazole IUPAC Name: 4-benzyl-1-[(4-bromophenyl)methylsulfanyl]-[1,2,4]triazolo[4,3-a]benzimidazole Traditional Name: 4-benzyl-1-[(4-bromobenzyl)thio]-[1,2,4]triazolo[4,3-a]benzimidazole Formula: C22H17BrN4S MolecularWeight: 449.36618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3N4C2=NN=C4SCC5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3N4C2=NN=C4SCC5=CC=C(C=C5)Br

InChI

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