1-[6-(2,5-dimethylpyrrol-1-yl)purin-9-yl]-3-[4-(diphenylmethyl)piperazin-1-yl]propan-2-ol

Systemtic Name: 1-[6-(2,5-dimethylpyrrol-1-yl)purin-9-yl]-3-[4-(diphenylmethyl)piperazin-1-yl]propan-2-ol Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-[6-(2,5-dimethylpyrrol-1-yl)purin-9-yl]propan-2-ol CAS Name: 1-[6-(2,5-dimethyl-1-pyrrolyl)-9-purinyl]-3-[4-(diphenylmethyl)-1-piperazinyl]-2-propanol IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-[6-(2,5-dimethylpyrrol-1-yl)purin-9-yl]propan-2-ol Traditional Name: 1-(4-benzhydrylpiperazino)-3-[6-(2,5-dimethylpyrrol-1-yl)purin-9-yl]propan-2-ol Formula: C31H35N7O MolecularWeight: 521.6559

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=NC=NC3=C2N=CN3CC(CN4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)O)C

Isomeric SMILES

CC1=CC=C(N1C2=NC=NC3=C2N=CN3CC(CN4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)O)C

InChI

InChI=1S/C31H35N7O/c1-23-13-14-24(2)38(23)31-28-30(32-21-33-31)37(22-34-28)20-27(39)19-35-15-17-36(18-16-35)29(25-9-5-3-6-10-25)26-11-7-4-8-12-26/h3-14,21-22,27,29,39H,15-20H2,1-2H3