6-(2,2-dimethylpropylamino)-9-(triphenylmethyl)purine-2-carbonitrile

Systemtic Name: 6-(2,2-dimethylpropylamino)-9-(triphenylmethyl)purine-2-carbonitrile Openeye Name: 6-(2,2-dimethylpropylamino)-9-trityl-purine-2-carbonitrile CAS Name: 6-(2,2-dimethylpropylamino)-9-(triphenylmethyl)-2-purinecarbonitrile IUPAC Name: 6-(2,2-dimethylpropylamino)-9-tritylpurine-2-carbonitrile Traditional Name: 6-(neopentylamino)-9-trityl-purine-2-carbonitrile Formula: C30H28N6 MolecularWeight: 472.58352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC1=NC(=NC2=C1N=CN2C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

CC(C)(C)CNC1=NC(=NC2=C1N=CN2C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C30H28N6/c1-29(2,3)20-32-27-26-28(35-25(19-31)34-27)36(21-33-26)30(22-13-7-4-8-14-22,23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-18,21H,20H2,1-3H3,(H,32,34,35)