5-[[3-[2-[(4-ethoxyphenyl)carbonylamino]ethyl]phenyl]sulfonylcarbamoyl]-3-pentyl-pyridine-2-carboxylic acid

Systemtic Name: 5-[[3-[2-[(4-ethoxyphenyl)carbonylamino]ethyl]phenyl]sulfonylcarbamoyl]-3-pentyl-pyridine-2-carboxylic acid Openeye Name: 5-[[3-[2-[(4-ethoxybenzoyl)amino]ethyl]phenyl]sulfonylcarbamoyl]-3-pentyl-pyridine-2-carboxylic acid CAS Name: 5-[[[3-[2-[[(4-ethoxyphenyl)-oxomethyl]amino]ethyl]phenyl]sulfonylamino]-oxomethyl]-3-pentyl-2-pyridinecarboxylic acid IUPAC Name: 5-[[3-[2-[(4-ethoxybenzoyl)amino]ethyl]phenyl]sulfonylcarbamoyl]-3-pentylpyridine-2-carboxylic acid Traditional Name: 3-amyl-5-[[3-[2-[(4-ethoxybenzoyl)amino]ethyl]phenyl]sulfonylcarbamoyl]picolinic acid Formula: C29H33N3O7S MolecularWeight: 567.65322

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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)C3=CC=C(C=C3)OCC)C(=O)O

Isomeric SMILES

CCCCCC1=C(N=CC(=C1)C(=O)NS(=O)(=O)C2=CC=CC(=C2)CCNC(=O)C3=CC=C(C=C3)OCC)C(=O)O

InChI

InChI=1S/C29H33N3O7S/c1-3-5-6-9-22-18-23(19-31-26(22)29(35)36)28(34)32-40(37,38)25-10-7-8-20(17-25)15-16-30-27(33)21-11-13-24(14-12-21)39-4-2/h7-8,10-14,17-19H,3-6,9,15-16H2,1-2H3,(H,30,33)(H,32,34)(H,35,36)