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

Systemtic Name: 9-(4-chlorophenyl)-8-(2,4-dichlorophenyl)-6-(4-pyridin-4-ylpiperazin-1-yl)purine Openeye Name: 9-(4-chlorophenyl)-8-(2,4-dichlorophenyl)-6-[4-(4-pyridyl)piperazin-1-yl]purine CAS Name: 9-(4-chlorophenyl)-8-(2,4-dichlorophenyl)-6-(4-pyridin-4-yl-1-piperazinyl)purine IUPAC Name: 9-(4-chlorophenyl)-8-(2,4-dichlorophenyl)-6-(4-pyridin-4-ylpiperazin-1-yl)purine Traditional Name: 9-(4-chlorophenyl)-8-(2,4-dichlorophenyl)-6-[4-(4-pyridyl)piperazino]purine Formula: C26H20Cl3N7 MolecularWeight: 536.8429

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C3=NC=NC4=C3N=C(N4C5=CC=C(C=C5)Cl)C6=C(C=C(C=C6)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C3=NC=NC4=C3N=C(N4C5=CC=C(C=C5)Cl)C6=C(C=C(C=C6)Cl)Cl

InChI

InChI=1S/C26H20Cl3N7/c27-17-1-4-20(5-2-17)36-24(21-6-3-18(28)15-22(21)29)33-23-25(31-16-32-26(23)36)35-13-11-34(12-14-35)19-7-9-30-10-8-19/h1-10,15-16H,11-14H2