5-[[4-[2-(2-methylpropanoylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: 5-[[4-[2-(2-methylpropanoylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: 5-[[4-[2-(2-methylpropanoylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[[[4-[2-[(2-methyl-1-oxopropyl)amino]ethyl]phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylate IUPAC Name: 5-[[4-[2-(2-methylpropanoylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[4-[2-(isobutyrylamino)ethyl]phenyl]sulfonylcarbamoyl]picolinate Formula: C19H20N3O6S- MolecularWeight: 418.4436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC(C)C(=O)NCCC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C19H21N3O6S/c1-12(2)17(23)20-10-9-13-3-6-15(7-4-13)29(27,28)22-18(24)14-5-8-16(19(25)26)21-11-14/h3-8,11-12H,9-10H2,1-2H3,(H,20,23)(H,22,24)(H,25,26)/p-1