3-[[(5-bromanylpyridin-3-yl)carbonylamino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide

Systemtic Name: 3-[[(5-bromanylpyridin-3-yl)carbonylamino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide Openeye Name: 3-[[(5-bromopyridine-3-carbonyl)amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide CAS Name: 3-[[[(5-bromo-3-pyridinyl)-oxomethyl]hydrazo]-oxomethyl]-N-(4-methoxyphenyl)benzenesulfonamide IUPAC Name: 3-[[(5-bromopyridine-3-carbonyl)amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide Traditional Name: 3-[[(5-bromonicotinoyl)amino]carbamoyl]-N-(4-methoxyphenyl)benzenesulfonamide Formula: C20H17BrN4O5S MolecularWeight: 505.34178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C20H17BrN4O5S/c1-30-17-7-5-16(6-8-17)25-31(28,29)18-4-2-3-13(10-18)19(26)23-24-20(27)14-9-15(21)12-22-11-14/h2-12,25H,1H3,(H,23,26)(H,24,27)