8-[4-(2-chloroethyl)piperazin-1-yl]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[4-(2-chloroethyl)piperazin-1-yl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[4-(2-chloroethyl)piperazin-1-yl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[4-(2-chloroethyl)-1-piperazinyl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[4-(2-chloroethyl)piperazin-1-yl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-[4-(2-chloroethyl)piperazino]-1,3-dimethyl-7H-purine-2,6-quinone Formula: C13H19ClN6O2 MolecularWeight: 326.78196

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCN(CC3)CCCl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCN(CC3)CCCl

InChI

InChI=1S/C13H19ClN6O2/c1-17-10-9(11(21)18(2)13(17)22)15-12(16-10)20-7-5-19(4-3-14)6-8-20/h3-8H2,1-2H3,(H,15,16)