5-[[4-(butylcarbamoyl)phenyl]sulfonylcarbamoyl]-3-pentyl-pyridine-2-carboxylate

Systemtic Name: 5-[[4-(butylcarbamoyl)phenyl]sulfonylcarbamoyl]-3-pentyl-pyridine-2-carboxylate Openeye Name: 5-[[4-(butylcarbamoyl)phenyl]sulfonylcarbamoyl]-3-pentyl-pyridine-2-carboxylate CAS Name: 5-[[[4-[butylamino(oxo)methyl]phenyl]sulfonylamino]-oxomethyl]-3-pentyl-2-pyridinecarboxylate IUPAC Name: 5-[[4-(butylcarbamoyl)phenyl]sulfonylcarbamoyl]-3-pentylpyridine-2-carboxylate Traditional Name: 3-amyl-5-[[4-(butylcarbamoyl)phenyl]sulfonylcarbamoyl]picolinate Formula: C23H28N3O6S- MolecularWeight: 474.54992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O6S/c1-3-5-7-8-17-14-18(15-25-20(17)23(29)30)22(28)26-33(31,32)19-11-9-16(10-12-19)21(27)24-13-6-4-2/h9-12,14-15H,3-8,13H2,1-2H3,(H,24,27)(H,26,28)(H,29,30)/p-1