2-azanyl-8-(trifluoromethyl)-1,4-dihydropurin-6-one

Systemtic Name: 2-azanyl-8-(trifluoromethyl)-1,4-dihydropurin-6-one Openeye Name: 2-amino-8-(trifluoromethyl)-1,4-dihydropurin-6-one CAS Name: 2-amino-8-(trifluoromethyl)-1,4-dihydropurin-6-one IUPAC Name: 2-amino-8-(trifluoromethyl)-1,4-dihydropurin-6-one Traditional Name: 2-amino-8-(trifluoromethyl)-1,4-dihydropurin-6-one Formula: C6H4F3N5O MolecularWeight: 219.12407

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Descriptors Computed from Structure

Canonical SMILES:

C12C(=NC(=N1)C(F)(F)F)C(=O)NC(=N2)N

Isomeric SMILES

C12C(=NC(=N1)C(F)(F)F)C(=O)NC(=N2)N

InChI

InChI=1S/C6H4F3N5O/c7-6(8,9)4-11-1-2(12-4)13-5(10)14-3(1)15/h2H,(H3,10,13,14,15)