2-[(5-bromanylpyridin-3-yl)carbonylamino]-4-methylsulfonyl-butanoic acid

Systemtic Name: 2-[(5-bromanylpyridin-3-yl)carbonylamino]-4-methylsulfonyl-butanoic acid Openeye Name: 2-[(5-bromopyridine-3-carbonyl)amino]-4-methylsulfonyl-butanoic acid CAS Name: 2-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-4-methylsulfonylbutanoic acid IUPAC Name: 2-[(5-bromopyridine-3-carbonyl)amino]-4-methylsulfonylbutanoic acid Traditional Name: 2-[(5-bromonicotinoyl)amino]-4-mesyl-butyric acid Formula: C11H13BrN2O5S MolecularWeight: 365.20032

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)O)NC(=O)C1=CC(=CN=C1)Br

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)O)NC(=O)C1=CC(=CN=C1)Br

InChI

InChI=1S/C11H13BrN2O5S/c1-20(18,19)3-2-9(11(16)17)14-10(15)7-4-8(12)6-13-5-7/h4-6,9H,2-3H2,1H3,(H,14,15)(H,16,17)