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

Systemtic Name: 1-(6-aminopurin-9-yl)-3-[4-(diphenylmethyl)piperazin-1-yl]propan-2-ol Openeye Name: 1-(6-aminopurin-9-yl)-3-(4-benzhydrylpiperazin-1-yl)propan-2-ol CAS Name: 1-(6-aminopurin-9-yl)-3-[4-(diphenylmethyl)-1-piperazinyl]-2-propanol IUPAC Name: 1-(6-aminopurin-9-yl)-3-(4-benzhydrylpiperazin-1-yl)propan-2-ol Traditional Name: 1-adenin-9-yl-3-(4-benzhydrylpiperazino)propan-2-ol Formula: C25H29N7O MolecularWeight: 443.54406

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CN2C=NC3=C2N=CN=C3N)O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC(CN2C=NC3=C2N=CN=C3N)O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H29N7O/c26-24-22-25(28-17-27-24)32(18-29-22)16-21(33)15-30-11-13-31(14-12-30)23(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-10,17-18,21,23,33H,11-16H2,(H2,26,27,28)