7-(2-chlorophenyl)-1,3-dimethyl-8-piperazin-2-yl-purine-2,6-dione

Systemtic Name: 7-(2-chlorophenyl)-1,3-dimethyl-8-piperazin-2-yl-purine-2,6-dione Openeye Name: 7-(2-chlorophenyl)-1,3-dimethyl-8-piperazin-2-yl-purine-2,6-dione CAS Name: 7-(2-chlorophenyl)-1,3-dimethyl-8-(2-piperazinyl)purine-2,6-dione IUPAC Name: 7-(2-chlorophenyl)-1,3-dimethyl-8-piperazin-2-ylpurine-2,6-dione Traditional Name: 7-(2-chlorophenyl)-1,3-dimethyl-8-piperazin-2-yl-xanthine Formula: C17H19ClN6O2 MolecularWeight: 374.82476

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)C3CNCCN3)C4=CC=CC=C4Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)C3CNCCN3)C4=CC=CC=C4Cl

InChI

InChI=1S/C17H19ClN6O2/c1-22-15-13(16(25)23(2)17(22)26)24(12-6-4-3-5-10(12)18)14(21-15)11-9-19-7-8-20-11/h3-6,11,19-20H,7-9H2,1-2H3