5-[3-[1-(1H-imidazol-5-yl)-6-phenyl-hexan-3-yl]sulfanyl-6-phenyl-hexyl]-1H-imidazole

Systemtic Name: 5-[3-[1-(1H-imidazol-5-yl)-6-phenyl-hexan-3-yl]sulfanyl-6-phenyl-hexyl]-1H-imidazole Openeye Name: 5-[3-[1-[2-(1H-imidazol-5-yl)ethyl]-4-phenyl-butyl]sulfanyl-6-phenyl-hexyl]-1H-imidazole CAS Name: 5-[3-[[1-(1H-imidazol-5-yl)-6-phenylhexan-3-yl]thio]-6-phenylhexyl]-1H-imidazole IUPAC Name: 5-[3-[1-(1H-imidazol-5-yl)-6-phenylhexan-3-yl]sulfanyl-6-phenylhexyl]-1H-imidazole Traditional Name: 5-[3-[[1-[2-(1H-imidazol-5-yl)ethyl]-4-phenyl-butyl]thio]-6-phenyl-hexyl]-1H-imidazole Formula: C30H38N4S MolecularWeight: 486.71452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(CCC2=CN=CN2)SC(CCCC3=CC=CC=C3)CCC4=CN=CN4

Isomeric SMILES

C1=CC=C(C=C1)CCCC(CCC2=CN=CN2)SC(CCCC3=CC=CC=C3)CCC4=CN=CN4

InChI

InChI=1S/C30H38N4S/c1-3-9-25(10-4-1)13-7-15-29(19-17-27-21-31-23-33-27)35-30(20-18-28-22-32-24-34-28)16-8-14-26-11-5-2-6-12-26/h1-6,9-12,21-24,29-30H,7-8,13-20H2,(H,31,33)(H,32,34)