1,7-bis[(4-chlorophenyl)methyl]-3-methyl-purine-2,6-dione

Systemtic Name: 1,7-bis[(4-chlorophenyl)methyl]-3-methyl-purine-2,6-dione Openeye Name: 1,7-bis[(4-chlorophenyl)methyl]-3-methyl-purine-2,6-dione CAS Name: 1,7-bis[(4-chlorophenyl)methyl]-3-methylpurine-2,6-dione IUPAC Name: 1,7-bis[(4-chlorophenyl)methyl]-3-methylpurine-2,6-dione Traditional Name: 1,7-bis(4-chlorobenzyl)-3-methyl-xanthine Formula: C20H16Cl2N4O2 MolecularWeight: 415.27264

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)CC3=CC=C(C=C3)Cl)N(C=N2)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)CC3=CC=C(C=C3)Cl)N(C=N2)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H16Cl2N4O2/c1-24-18-17(25(12-23-18)10-13-2-6-15(21)7-3-13)19(27)26(20(24)28)11-14-4-8-16(22)9-5-14/h2-9,12H,10-11H2,1H3