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

Systemtic Name: [4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 5-bromanylpyridine-3-carboxylate Openeye Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [4-amino-6-(dimethylamino)-s-triazin-2-yl]methyl ester Formula: C12H13BrN6O2 MolecularWeight: 353.17462

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC(=N1)N)COC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CN(C)C1=NC(=NC(=N1)N)COC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C12H13BrN6O2/c1-19(2)12-17-9(16-11(14)18-12)6-21-10(20)7-3-8(13)5-15-4-7/h3-5H,6H2,1-2H3,(H2,14,16,17,18)