6-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-7H-purine

Systemtic Name: 6-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-7H-purine Openeye Name: 6-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]-7H-purine CAS Name: 6-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-7H-purine IUPAC Name: 6-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]-7H-purine Traditional Name: 6-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]-7H-purine Formula: C17H22N8 MolecularWeight: 338.41018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C3=NC=NC4=C3NC=N4

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C3=NC=NC4=C3NC=N4

InChI

InChI=1S/C17H22N8/c1-11(2)15-22-12(3)8-13(23-15)24-4-6-25(7-5-24)17-14-16(19-9-18-14)20-10-21-17/h8-11H,4-7H2,1-3H3,(H,18,19,20,21)