1-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-(purin-4-ylamino)propan-2-ol

Systemtic Name: 1-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-(purin-4-ylamino)propan-2-ol Openeye Name: 1-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-(purin-4-ylamino)propan-2-ol CAS Name: 1-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-3-(4-purinylamino)-2-propanol IUPAC Name: 1-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-3-(purin-4-ylamino)propan-2-ol Traditional Name: 1-[4-[bis(4-fluorophenyl)methyl]piperazino]-3-(purin-4-ylamino)propan-2-ol Formula: C25H27F2N7O MolecularWeight: 479.524986

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CNC23C(=NC=N2)C=NC=N3)O)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1CC(CNC23C(=NC=N2)C=NC=N3)O)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H27F2N7O/c26-20-5-1-18(2-6-20)24(19-3-7-21(27)8-4-19)34-11-9-33(10-12-34)15-22(35)13-30-25-23(29-17-32-25)14-28-16-31-25/h1-8,14,16-17,22,24,30,35H,9-13,15H2