1-[[7-[bis(4-fluorophenyl)methyl]purin-8-yl]amino]-3-piperazin-1-yl-propan-2-ol

Systemtic Name: 1-[[7-[bis(4-fluorophenyl)methyl]purin-8-yl]amino]-3-piperazin-1-yl-propan-2-ol Openeye Name: 1-[[7-[bis(4-fluorophenyl)methyl]purin-8-yl]amino]-3-piperazin-1-yl-propan-2-ol CAS Name: 1-[[7-[bis(4-fluorophenyl)methyl]-8-purinyl]amino]-3-(1-piperazinyl)-2-propanol IUPAC Name: 1-[[7-[bis(4-fluorophenyl)methyl]purin-8-yl]amino]-3-piperazin-1-ylpropan-2-ol Traditional Name: 1-[[7-[bis(4-fluorophenyl)methyl]purin-8-yl]amino]-3-piperazino-propan-2-ol Formula: C25H27F2N7O MolecularWeight: 479.524986

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC(CNC2=NC3=NC=NC=C3N2C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F)O

Isomeric SMILES

C1CN(CCN1)CC(CNC2=NC3=NC=NC=C3N2C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F)O

InChI

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