2-[5-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]sulfanyl]pentyl]-1H-benzimidazole

Systemtic Name: 2-[5-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]sulfanyl]pentyl]-1H-benzimidazole Openeye Name: 2-[5-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]sulfanyl]pentyl]-1H-benzimidazole CAS Name: 2-[5-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]thio]pentyl]-1H-benzimidazole IUPAC Name: 2-[5-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]sulfanyl]pentyl]-1H-benzimidazole Traditional Name: 2-[5-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]thio]pentyl]-1H-benzimidazole Formula: C29H30N4O2S MolecularWeight: 498.6391

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(N=C(N2)SCCCCCC3=NC4=CC=CC=C4N3)C5=CC=C(C=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(N=C(N2)SCCCCCC3=NC4=CC=CC=C4N3)C5=CC=C(C=C5)OC

InChI

InChI=1S/C29H30N4O2S/c1-34-22-15-11-20(12-16-22)27-28(21-13-17-23(35-2)18-14-21)33-29(32-27)36-19-7-3-4-10-26-30-24-8-5-6-9-25(24)31-26/h5-6,8-9,11-18H,3-4,7,10,19H2,1-2H3,(H,30,31)(H,32,33)