3,7-dimethyl-1-[3-(4-pyrazin-2-ylpiperazin-1-yl)propyl]purine-2,6-dione

Systemtic Name: 3,7-dimethyl-1-[3-(4-pyrazin-2-ylpiperazin-1-yl)propyl]purine-2,6-dione Openeye Name: 3,7-dimethyl-1-[3-(4-pyrazin-2-ylpiperazin-1-yl)propyl]purine-2,6-dione CAS Name: 3,7-dimethyl-1-[3-[4-(2-pyrazinyl)-1-piperazinyl]propyl]purine-2,6-dione IUPAC Name: 3,7-dimethyl-1-[3-(4-pyrazin-2-ylpiperazin-1-yl)propyl]purine-2,6-dione Traditional Name: 3,7-dimethyl-1-[3-(4-pyrazin-2-ylpiperazino)propyl]xanthine Formula: C18H24N8O2 MolecularWeight: 384.43556

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCN3CCN(CC3)C4=NC=CN=C4

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCN3CCN(CC3)C4=NC=CN=C4

InChI

InChI=1S/C18H24N8O2/c1-22-13-21-16-15(22)17(27)26(18(28)23(16)2)7-3-6-24-8-10-25(11-9-24)14-12-19-4-5-20-14/h4-5,12-13H,3,6-11H2,1-2H3