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

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-3-(6-methoxypurin-9-yl)propan-2-ol Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(6-methoxypurin-9-yl)propan-2-ol CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-3-(6-methoxy-9-purinyl)-2-propanol IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(6-methoxypurin-9-yl)propan-2-ol Traditional Name: 1-(4-benzhydrylpiperazino)-3-(6-methoxypurin-9-yl)propan-2-ol Formula: C26H30N6O2 MolecularWeight: 458.5554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=NC2=C1N=CN2CC(CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

COC1=NC=NC2=C1N=CN2CC(CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C26H30N6O2/c1-34-26-23-25(27-18-28-26)32(19-29-23)17-22(33)16-30-12-14-31(15-13-30)24(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-11,18-19,22,24,33H,12-17H2,1H3