6-[4-(2,5-dimethylphenyl)piperazin-1-yl]-7H-purine

Systemtic Name: 6-[4-(2,5-dimethylphenyl)piperazin-1-yl]-7H-purine Openeye Name: 6-[4-(2,5-dimethylphenyl)piperazin-1-yl]-7H-purine CAS Name: 6-[4-(2,5-dimethylphenyl)-1-piperazinyl]-7H-purine IUPAC Name: 6-[4-(2,5-dimethylphenyl)piperazin-1-yl]-7H-purine Traditional Name: 6-[4-(2,5-dimethylphenyl)piperazino]-7H-purine Formula: C17H20N6 MolecularWeight: 308.3809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C3=NC=NC4=C3NC=N4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C3=NC=NC4=C3NC=N4

InChI

InChI=1S/C17H20N6/c1-12-3-4-13(2)14(9-12)22-5-7-23(8-6-22)17-15-16(19-10-18-15)20-11-21-17/h3-4,9-11H,5-8H2,1-2H3,(H,18,19,20,21)