[4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 5-bromanylpyridine-3-carboxylate

Systemtic Name: [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 5-bromanylpyridine-3-carboxylate Openeye Name: [4-[methyl(2-thienylsulfonyl)amino]phenyl] 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] ester IUPAC Name: [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid [4-[methyl(2-thienylsulfonyl)amino]phenyl] ester Formula: C17H13BrN2O4S2 MolecularWeight: 453.33012

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OC(=O)C2=CC(=CN=C2)Br)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(C1=CC=C(C=C1)OC(=O)C2=CC(=CN=C2)Br)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H13BrN2O4S2/c1-20(26(22,23)16-3-2-8-25-16)14-4-6-15(7-5-14)24-17(21)12-9-13(18)11-19-10-12/h2-11H,1H3