3-(2-aminophenyl)-1-[(2-fluorophenyl)methyl]-7H-purine-2,6-dione

Systemtic Name: 3-(2-aminophenyl)-1-[(2-fluorophenyl)methyl]-7H-purine-2,6-dione Openeye Name: 3-(2-aminophenyl)-1-[(2-fluorophenyl)methyl]-7H-purine-2,6-dione CAS Name: 3-(2-aminophenyl)-1-[(2-fluorophenyl)methyl]-7H-purine-2,6-dione IUPAC Name: 3-(2-aminophenyl)-1-[(2-fluorophenyl)methyl]-7H-purine-2,6-dione Traditional Name: 3-(2-aminophenyl)-1-(2-fluorobenzyl)-7H-purine-2,6-quinone Formula: C18H14FN5O2 MolecularWeight: 351.334463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=O)C3=C(N=CN3)N(C2=O)C4=CC=CC=C4N)F

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=O)C3=C(N=CN3)N(C2=O)C4=CC=CC=C4N)F

InChI

InChI=1S/C18H14FN5O2/c19-12-6-2-1-5-11(12)9-23-17(25)15-16(22-10-21-15)24(18(23)26)14-8-4-3-7-13(14)20/h1-8,10H,9,20H2,(H,21,22)