2-(3-aminophenyl)-7-[(2-fluorophenyl)methyl]-3H-purin-6-one

Systemtic Name: 2-(3-aminophenyl)-7-[(2-fluorophenyl)methyl]-3H-purin-6-one Openeye Name: 2-(3-aminophenyl)-7-[(2-fluorophenyl)methyl]-3H-purin-6-one CAS Name: 2-(3-aminophenyl)-7-[(2-fluorophenyl)methyl]-3H-purin-6-one IUPAC Name: 2-(3-aminophenyl)-7-[(2-fluorophenyl)methyl]-3H-purin-6-one Traditional Name: 2-(3-aminophenyl)-7-(2-fluorobenzyl)-3H-purin-6-one Formula: C18H14FN5O MolecularWeight: 335.335063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=NC3=C2C(=O)N=C(N3)C4=CC(=CC=C4)N)F

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=NC3=C2C(=O)N=C(N3)C4=CC(=CC=C4)N)F

InChI

InChI=1S/C18H14FN5O/c19-14-7-2-1-4-12(14)9-24-10-21-17-15(24)18(25)23-16(22-17)11-5-3-6-13(20)8-11/h1-8,10H,9,20H2,(H,22,23,25)