2-[7-(1H-benzimidazol-2-yl)heptylsulfanyl]-1H-benzimidazole

Systemtic Name: 2-[7-(1H-benzimidazol-2-yl)heptylsulfanyl]-1H-benzimidazole Openeye Name: 2-[7-(1H-benzimidazol-2-yl)heptylsulfanyl]-1H-benzimidazole CAS Name: 2-[7-(1H-benzimidazol-2-yl)heptylthio]-1H-benzimidazole IUPAC Name: 2-[7-(1H-benzimidazol-2-yl)heptylsulfanyl]-1H-benzimidazole Traditional Name: 2-[7-(1H-benzimidazol-2-yl)heptylthio]-1H-benzimidazole Formula: C21H24N4S MolecularWeight: 364.50706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CCCCCCCSC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CCCCCCCSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H24N4S/c1(2-4-14-20-22-16-10-5-6-11-17(16)23-20)3-9-15-26-21-24-18-12-7-8-13-19(18)25-21/h5-8,10-13H,1-4,9,14-15H2,(H,22,23)(H,24,25)