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

Systemtic Name: propyl 5-[[4-[2-(butanoylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: propyl 5-[[4-[2-(butanoylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[oxo-[[4-[2-(1-oxobutylamino)ethyl]phenyl]sulfonylamino]methyl]-2-pyridinecarboxylic acid propyl ester IUPAC Name: propyl 5-[[4-[2-(butanoylamino)ethyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[4-(2-butyramidoethyl)phenyl]sulfonylcarbamoyl]picolinic acid propyl ester Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NCCC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)OCCC

Isomeric SMILES

CCCC(=O)NCCC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)OCCC

InChI

InChI=1S/C22H27N3O6S/c1-3-5-20(26)23-13-12-16-6-9-18(10-7-16)32(29,30)25-21(27)17-8-11-19(24-15-17)22(28)31-14-4-2/h6-11,15H,3-5,12-14H2,1-2H3,(H,23,26)(H,25,27)