7-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-8-diazanyl-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-8-diazanyl-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[(2-chloro-6-fluoro-phenyl)methyl]-8-hydrazino-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[(2-chloro-6-fluorophenyl)methyl]-8-hydrazinyl-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[(2-chloro-6-fluorophenyl)methyl]-8-hydrazinyl-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(2-chloro-6-fluoro-benzyl)-8-hydrazino-1,3-dimethyl-xanthine Formula: C14H14ClFN6O2 MolecularWeight: 352.751363

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NN)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NN)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C14H14ClFN6O2/c1-20-11-10(12(23)21(2)14(20)24)22(13(18-11)19-17)6-7-8(15)4-3-5-9(7)16/h3-5H,6,17H2,1-2H3,(H,18,19)