1-[2-(3-tert-butylphenyl)-1-iodanyl-5-methyl-imidazol-4-yl]-2-[4-(diphenylmethyl)piperazin-1-yl]ethanol

Systemtic Name: 1-[2-(3-tert-butylphenyl)-1-iodanyl-5-methyl-imidazol-4-yl]-2-[4-(diphenylmethyl)piperazin-1-yl]ethanol Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)-1-[2-(3-tert-butylphenyl)-1-iodo-5-methyl-imidazol-4-yl]ethanol CAS Name: 1-[2-(3-tert-butylphenyl)-1-iodo-5-methyl-4-imidazolyl]-2-[4-(diphenylmethyl)-1-piperazinyl]ethanol IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)-1-[2-(3-tert-butylphenyl)-1-iodo-5-methylimidazol-4-yl]ethanol Traditional Name: 2-(4-benzhydrylpiperazino)-1-[2-(3-tert-butylphenyl)-1-iodo-5-methyl-imidazol-4-yl]ethanol Formula: C33H39IN4O MolecularWeight: 634.59343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1I)C2=CC(=CC=C2)C(C)(C)C)C(CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

CC1=C(N=C(N1I)C2=CC(=CC=C2)C(C)(C)C)C(CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C33H39IN4O/c1-24-30(35-32(38(24)34)27-16-11-17-28(22-27)33(2,3)4)29(39)23-36-18-20-37(21-19-36)31(25-12-7-5-8-13-25)26-14-9-6-10-15-26/h5-17,22,29,31,39H,18-21,23H2,1-4H3