6-[bis(4-fluorophenyl)methyl]-2-piperazin-1-yl-3-propylsulfanyl-purine

Systemtic Name: 6-[bis(4-fluorophenyl)methyl]-2-piperazin-1-yl-3-propylsulfanyl-purine Openeye Name: 6-[bis(4-fluorophenyl)methyl]-2-piperazin-1-yl-3-propylsulfanyl-purine CAS Name: 6-[bis(4-fluorophenyl)methyl]-2-(1-piperazinyl)-3-(propylthio)purine IUPAC Name: 6-[bis(4-fluorophenyl)methyl]-2-piperazin-1-yl-3-propylsulfanylpurine Traditional Name: 6-[bis(4-fluorophenyl)methyl]-2-piperazino-3-(propylthio)purine Formula: C25H26F2N6S MolecularWeight: 480.575946

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Descriptors Computed from Structure

Canonical SMILES:

CCCSN1C2=NC=NC2=C(N=C1N3CCNCC3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

CCCSN1C2=NC=NC2=C(N=C1N3CCNCC3)C(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H26F2N6S/c1-2-15-34-33-24-23(29-16-30-24)22(31-25(33)32-13-11-28-12-14-32)21(17-3-7-19(26)8-4-17)18-5-9-20(27)10-6-18/h3-10,16,21,28H,2,11-15H2,1H3