5-(2,2-dimethyl-1-oxidanyl-propyl)-2-propyl-3-[[4-[2-[1-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]phenyl]methyl]imidazole-4-carbonitrile

Systemtic Name: 5-(2,2-dimethyl-1-oxidanyl-propyl)-2-propyl-3-[[4-[2-[1-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]phenyl]phenyl]methyl]imidazole-4-carbonitrile Openeye Name: 5-(1-hydroxy-2,2-dimethyl-propyl)-2-propyl-3-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carbonitrile CAS Name: 5-(1-hydroxy-2,2-dimethylpropyl)-2-propyl-3-[[4-[2-[1-(triphenylmethyl)-5-tetrazolyl]phenyl]phenyl]methyl]-4-imidazolecarbonitrile IUPAC Name: 5-(1-hydroxy-2,2-dimethylpropyl)-2-propyl-3-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carbonitrile Traditional Name: 5-(1-hydroxy-2,2-dimethyl-propyl)-2-propyl-3-[4-[2-(1-trityltetrazol-5-yl)phenyl]benzyl]imidazole-4-carbonitrile Formula: C45H43N7O MolecularWeight: 697.86922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN=NN4C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C#N)C(C(C)(C)C)O

Isomeric SMILES

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NN=NN4C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C#N)C(C(C)(C)C)O

InChI

InChI=1S/C45H43N7O/c1-5-17-40-47-41(42(53)44(2,3)4)39(30-46)51(40)31-32-26-28-33(29-27-32)37-24-15-16-25-38(37)43-48-49-50-52(43)45(34-18-9-6-10-19-34,35-20-11-7-12-21-35)36-22-13-8-14-23-36/h6-16,18-29,42,53H,5,17,31H2,1-4H3