1,3-dimethyl-8-(4-propanoylpiperazin-1-yl)-7H-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-8-(4-propanoylpiperazin-1-yl)-7H-purine-2,6-dione Openeye Name: 1,3-dimethyl-8-(4-propanoylpiperazin-1-yl)-7H-purine-2,6-dione CAS Name: 1,3-dimethyl-8-[4-(1-oxopropyl)-1-piperazinyl]-7H-purine-2,6-dione IUPAC Name: 1,3-dimethyl-8-(4-propanoylpiperazin-1-yl)-7H-purine-2,6-dione Traditional Name: 1,3-dimethyl-8-(4-propionylpiperazino)-7H-purine-2,6-quinone Formula: C14H20N6O3 MolecularWeight: 320.347

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCN(CC1)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C

Isomeric SMILES

CCC(=O)N1CCN(CC1)C2=NC3=C(N2)C(=O)N(C(=O)N3C)C

InChI

InChI=1S/C14H20N6O3/c1-4-9(21)19-5-7-20(8-6-19)13-15-10-11(16-13)17(2)14(23)18(3)12(10)22/h4-8H2,1-3H3,(H,15,16)