1-[4-(diphenylmethyl)piperazin-1-yl]-3-(6-imidazol-1-ylpurin-9-yl)propan-2-ol

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-3-(6-imidazol-1-ylpurin-9-yl)propan-2-ol Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(6-imidazol-1-ylpurin-9-yl)propan-2-ol CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-3-[6-(1-imidazolyl)-9-purinyl]-2-propanol IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(6-imidazol-1-ylpurin-9-yl)propan-2-ol Traditional Name: 1-(4-benzhydrylpiperazino)-3-(6-imidazol-1-ylpurin-9-yl)propan-2-ol Formula: C28H30N8O MolecularWeight: 494.5908

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CN2C=NC3=C2N=CN=C3N4C=CN=C4)O)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CC(CN2C=NC3=C2N=CN=C3N4C=CN=C4)O)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C28H30N8O/c37-24(18-36-21-32-25-27(30-19-31-28(25)36)35-12-11-29-20-35)17-33-13-15-34(16-14-33)26(22-7-3-1-4-8-22)23-9-5-2-6-10-23/h1-12,19-21,24,26,37H,13-18H2