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

Systemtic Name: 7-(3-chlorophenyl)-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione Openeye Name: 7-(3-chlorophenyl)-1,3-dimethyl-8-piperazin-1-yl-purine-2,6-dione CAS Name: 7-(3-chlorophenyl)-1,3-dimethyl-8-(1-piperazinyl)purine-2,6-dione IUPAC Name: 7-(3-chlorophenyl)-1,3-dimethyl-8-piperazin-1-ylpurine-2,6-dione Traditional Name: 7-(3-chlorophenyl)-1,3-dimethyl-8-piperazino-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)N3CCNCC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCNCC3)C4=CC(=CC=C4)Cl

InChI

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