7-[(4-bromophenyl)methyl]-8-diazanyl-3-methyl-purine-2,6-dione

Systemtic Name: 7-[(4-bromophenyl)methyl]-8-diazanyl-3-methyl-purine-2,6-dione Openeye Name: 7-[(4-bromophenyl)methyl]-8-hydrazino-3-methyl-purine-2,6-dione CAS Name: 7-[(4-bromophenyl)methyl]-8-hydrazinyl-3-methylpurine-2,6-dione IUPAC Name: 7-[(4-bromophenyl)methyl]-8-hydrazinyl-3-methylpurine-2,6-dione Traditional Name: 7-(4-bromobenzyl)-8-hydrazino-3-methyl-xanthine Formula: C13H13BrN6O2 MolecularWeight: 365.18532

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NN)CC3=CC=C(C=C3)Br

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)NN)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C13H13BrN6O2/c1-19-10-9(11(21)17-13(19)22)20(12(16-10)18-15)6-7-2-4-8(14)5-3-7/h2-5H,6,15H2,1H3,(H,16,18)(H,17,21,22)