propyl 5-[[4-(4-phenylbutanoylamino)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: propyl 5-[[4-(4-phenylbutanoylamino)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: propyl 5-[[4-(4-phenylbutanoylamino)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[oxo-[[4-[(1-oxo-4-phenylbutyl)amino]phenyl]sulfonylamino]methyl]-2-pyridinecarboxylic acid propyl ester IUPAC Name: propyl 5-[[4-(4-phenylbutanoylamino)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[4-(4-phenylbutanoylamino)phenyl]sulfonylcarbamoyl]picolinic acid propyl ester Formula: C26H27N3O6S MolecularWeight: 509.57408

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCC3=CC=CC=C3

Isomeric SMILES

CCCOC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O6S/c1-2-17-35-26(32)23-16-11-20(18-27-23)25(31)29-36(33,34)22-14-12-21(13-15-22)28-24(30)10-6-9-19-7-4-3-5-8-19/h3-5,7-8,11-16,18H,2,6,9-10,17H2,1H3,(H,28,30)(H,29,31)