1-[4-(diphenylmethyl)piperazin-1-yl]-3-[6-(methylamino)purin-3-yl]propan-2-ol

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-3-[6-(methylamino)purin-3-yl]propan-2-ol Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-[6-(methylamino)purin-3-yl]propan-2-ol CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-3-[6-(methylamino)-3-purinyl]-2-propanol IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-[6-(methylamino)purin-3-yl]propan-2-ol Traditional Name: 1-(4-benzhydrylpiperazino)-3-[6-(methylamino)purin-3-yl]propan-2-ol Formula: C26H31N7O MolecularWeight: 457.57064

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C2C(=NC=N2)N(C=N1)CC(CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

Isomeric SMILES

CNC1=C2C(=NC=N2)N(C=N1)CC(CN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)O

InChI

InChI=1S/C26H31N7O/c1-27-25-23-26(29-18-28-23)33(19-30-25)17-22(34)16-31-12-14-32(15-13-31)24(20-8-4-2-5-9-20)21-10-6-3-7-11-21/h2-11,18-19,22,24,27,34H,12-17H2,1H3