[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 5-bromanylfuran-2-carboxylate

Systemtic Name: [4,6-bis(azanyl)-1,3,5-triazin-2-yl]methyl 5-bromanylfuran-2-carboxylate Openeye Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 5-bromofuran-2-carboxylate CAS Name: 5-bromo-2-furancarboxylic acid (4,6-diamino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4,6-diamino-1,3,5-triazin-2-yl)methyl 5-bromofuran-2-carboxylate Traditional Name: 5-bromofuran-2-carboxylic acid (4,6-diamino-s-triazin-2-yl)methyl ester Formula: C9H8BrN5O3 MolecularWeight: 314.09552

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)Br)C(=O)OCC2=NC(=NC(=N2)N)N

Isomeric SMILES

C1=C(OC(=C1)Br)C(=O)OCC2=NC(=NC(=N2)N)N

InChI

InChI=1S/C9H8BrN5O3/c10-5-2-1-4(18-5)7(16)17-3-6-13-8(11)15-9(12)14-6/h1-2H,3H2,(H4,11,12,13,14,15)