9-(4-chlorophenyl)-8-(2,4-dichlorophenyl)-6-piperidin-1-yl-purine

Systemtic Name: 9-(4-chlorophenyl)-8-(2,4-dichlorophenyl)-6-piperidin-1-yl-purine Openeye Name: 9-(4-chlorophenyl)-8-(2,4-dichlorophenyl)-6-(1-piperidyl)purine CAS Name: 9-(4-chlorophenyl)-8-(2,4-dichlorophenyl)-6-(1-piperidinyl)purine IUPAC Name: 9-(4-chlorophenyl)-8-(2,4-dichlorophenyl)-6-piperidin-1-ylpurine Traditional Name: 9-(4-chlorophenyl)-8-(2,4-dichlorophenyl)-6-piperidino-purine Formula: C22H18Cl3N5 MolecularWeight: 458.77082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=NC3=C2N=C(N3C4=CC=C(C=C4)Cl)C5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

C1CCN(CC1)C2=NC=NC3=C2N=C(N3C4=CC=C(C=C4)Cl)C5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C22H18Cl3N5/c23-14-4-7-16(8-5-14)30-20(17-9-6-15(24)12-18(17)25)28-19-21(26-13-27-22(19)30)29-10-2-1-3-11-29/h4-9,12-13H,1-3,10-11H2