5-[[3-[2-(butanoylamino)ethyl]phenyl]sulfonylcarbamoyl]-3-pentyl-pyridine-2-carboxylate

Systemtic Name: 5-[[3-[2-(butanoylamino)ethyl]phenyl]sulfonylcarbamoyl]-3-pentyl-pyridine-2-carboxylate Openeye Name: 5-[[3-[2-(butanoylamino)ethyl]phenyl]sulfonylcarbamoyl]-3-pentyl-pyridine-2-carboxylate CAS Name: 5-[oxo-[[3-[2-(1-oxobutylamino)ethyl]phenyl]sulfonylamino]methyl]-3-pentyl-2-pyridinecarboxylate IUPAC Name: 5-[[3-[2-(butanoylamino)ethyl]phenyl]sulfonylcarbamoyl]-3-pentylpyridine-2-carboxylate Traditional Name: 3-amyl-5-[[3-(2-butyramidoethyl)phenyl]sulfonylcarbamoyl]picolinate Formula: C24H30N3O6S- MolecularWeight: 488.5765

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(N=CC(=C1)C(=O)NS(=O)(=O)C2=CC=CC(=C2)CCNC(=O)CCC)C(=O)[O-]

Isomeric SMILES

CCCCCC1=C(N=CC(=C1)C(=O)NS(=O)(=O)C2=CC=CC(=C2)CCNC(=O)CCC)C(=O)[O-]

InChI

InChI=1S/C24H31N3O6S/c1-3-5-6-10-18-15-19(16-26-22(18)24(30)31)23(29)27-34(32,33)20-11-7-9-17(14-20)12-13-25-21(28)8-4-2/h7,9,11,14-16H,3-6,8,10,12-13H2,1-2H3,(H,25,28)(H,27,29)(H,30,31)/p-1