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

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-3-(6-piperidin-1-ylpurin-3-yl)propan-2-ol Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-[6-(1-piperidyl)purin-3-yl]propan-2-ol CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-3-[6-(1-piperidinyl)-3-purinyl]-2-propanol IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(6-piperidin-1-ylpurin-3-yl)propan-2-ol Traditional Name: 1-(4-benzhydrylpiperazino)-3-(6-piperidinopurin-3-yl)propan-2-ol Formula: C30H37N7O MolecularWeight: 511.66108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C(=NC=N3)N(C=N2)CC(CN4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)O

Isomeric SMILES

C1CCN(CC1)C2=C3C(=NC=N3)N(C=N2)CC(CN4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)O

InChI

InChI=1S/C30H37N7O/c38-26(21-37-23-33-30(27-29(37)32-22-31-27)36-14-8-3-9-15-36)20-34-16-18-35(19-17-34)28(24-10-4-1-5-11-24)25-12-6-2-7-13-25/h1-2,4-7,10-13,22-23,26,28,38H,3,8-9,14-21H2