2,2-dimethyl-1-[4-(7H-purin-6-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 2,2-dimethyl-1-[4-(7H-purin-6-yl)piperazin-1-yl]propan-1-one Openeye Name: 2,2-dimethyl-1-[4-(7H-purin-6-yl)piperazin-1-yl]propan-1-one CAS Name: 2,2-dimethyl-1-[4-(7H-purin-6-yl)-1-piperazinyl]-1-propanone IUPAC Name: 2,2-dimethyl-1-[4-(7H-purin-6-yl)piperazin-1-yl]propan-1-one Traditional Name: 2,2-dimethyl-1-[4-(7H-purin-6-yl)piperazino]propan-1-one Formula: C14H20N6O MolecularWeight: 288.3482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N1CCN(CC1)C2=NC=NC3=C2NC=N3

Isomeric SMILES

CC(C)(C)C(=O)N1CCN(CC1)C2=NC=NC3=C2NC=N3

InChI

InChI=1S/C14H20N6O/c1-14(2,3)13(21)20-6-4-19(5-7-20)12-10-11(16-8-15-10)17-9-18-12/h8-9H,4-7H2,1-3H3,(H,15,16,17,18)