4-ethyl-1-[[1-(phenylmethyl)benzimidazol-2-yl]methylsulfanyl]-[1,2,4]triazolo[4,3-a]benzimidazole

Systemtic Name: 4-ethyl-1-[[1-(phenylmethyl)benzimidazol-2-yl]methylsulfanyl]-[1,2,4]triazolo[4,3-a]benzimidazole Openeye Name: 1-[(1-benzylbenzimidazol-2-yl)methylsulfanyl]-4-ethyl-[1,2,4]triazolo[4,3-a]benzimidazole CAS Name: 4-ethyl-1-[[1-(phenylmethyl)-2-benzimidazolyl]methylthio]-[1,2,4]triazolo[4,3-a]benzimidazole IUPAC Name: 1-[(1-benzylbenzimidazol-2-yl)methylsulfanyl]-4-ethyl-[1,2,4]triazolo[4,3-a]benzimidazole Traditional Name: 1-[(1-benzylbenzimidazol-2-yl)methylthio]-4-ethyl-[1,2,4]triazolo[4,3-a]benzimidazole Formula: C25H22N6S MolecularWeight: 438.54738

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N3C1=NN=C3SCC4=NC5=CC=CC=C5N4CC6=CC=CC=C6

Isomeric SMILES

CCN1C2=CC=CC=C2N3C1=NN=C3SCC4=NC5=CC=CC=C5N4CC6=CC=CC=C6

InChI

InChI=1S/C25H22N6S/c1-2-29-21-14-8-9-15-22(21)31-24(29)27-28-25(31)32-17-23-26-19-12-6-7-13-20(19)30(23)16-18-10-4-3-5-11-18/h3-15H,2,16-17H2,1H3