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

Systemtic Name: 6-[4-(2,5-dimethylphenyl)piperazin-1-yl]-7H-purin-2-amine Openeye Name: 6-[4-(2,5-dimethylphenyl)piperazin-1-yl]-7H-purin-2-amine CAS Name: 6-[4-(2,5-dimethylphenyl)-1-piperazinyl]-7H-purin-2-amine IUPAC Name: 6-[4-(2,5-dimethylphenyl)piperazin-1-yl]-7H-purin-2-amine Traditional Name: [6-[4-(2,5-dimethylphenyl)piperazino]-7H-purin-2-yl]amine Formula: C17H21N7 MolecularWeight: 323.39554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N7/c1-11-3-4-12(2)13(9-11)23-5-7-24(8-6-23)16-14-15(20-10-19-14)21-17(18)22-16/h3-4,9-10H,5-8H2,1-2H3,(H3,18,19,20,21,22)