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

Systemtic Name: 1-[4-(diphenylmethyl)-3-methyl-piperazin-1-yl]-3-(6-pyrrol-1-ylpurin-9-yl)propan-2-ol Openeye Name: 1-(4-benzhydryl-3-methyl-piperazin-1-yl)-3-(6-pyrrol-1-ylpurin-9-yl)propan-2-ol CAS Name: 1-[4-(diphenylmethyl)-3-methyl-1-piperazinyl]-3-[6-(1-pyrrolyl)-9-purinyl]-2-propanol IUPAC Name: 1-(4-benzhydryl-3-methylpiperazin-1-yl)-3-(6-pyrrol-1-ylpurin-9-yl)propan-2-ol Traditional Name: 1-(4-benzhydryl-3-methyl-piperazino)-3-(6-pyrrol-1-ylpurin-9-yl)propan-2-ol Formula: C30H33N7O MolecularWeight: 507.62932

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)CC(CN4C=NC5=C4N=CN=C5N6C=CC=C6)O

Isomeric SMILES

CC1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)CC(CN4C=NC5=C4N=CN=C5N6C=CC=C6)O

InChI

InChI=1S/C30H33N7O/c1-23-18-34(16-17-37(23)28(24-10-4-2-5-11-24)25-12-6-3-7-13-25)19-26(38)20-36-22-33-27-29(31-21-32-30(27)36)35-14-8-9-15-35/h2-15,21-23,26,28,38H,16-20H2,1H3