[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 2-bromanyl-5-fluoranyl-benzoate

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 2-bromanyl-5-fluoranyl-benzoate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 2-bromo-5-fluoro-benzoate CAS Name: 2-bromo-5-fluorobenzoic acid (4,6-diamino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 2-bromo-5-fluorobenzoate Traditional Name: 2-bromo-5-fluoro-benzoic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C11H9BrFN5O2 MolecularWeight: 342.123863

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)C(=O)OCC2=NC(=NC(=N2)N)N)Br

Isomeric SMILES

C1=CC(=C(C=C1F)C(=O)OCC2=NC(=NC(=N2)N)N)Br

InChI

InChI=1S/C11H9BrFN5O2/c12-7-2-1-5(13)3-6(7)9(19)20-4-8-16-10(14)18-11(15)17-8/h1-3H,4H2,(H4,14,15,16,17,18)