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

Systemtic Name: 5-[[4-(2-methylpentanoylamino)phenyl]sulfonylcarbamoyl]-3-pentyl-pyridine-2-carboxylate Openeye Name: 5-[[4-(2-methylpentanoylamino)phenyl]sulfonylcarbamoyl]-3-pentyl-pyridine-2-carboxylate CAS Name: 5-[[[4-[(2-methyl-1-oxopentyl)amino]phenyl]sulfonylamino]-oxomethyl]-3-pentyl-2-pyridinecarboxylate IUPAC Name: 5-[[4-(2-methylpentanoylamino)phenyl]sulfonylcarbamoyl]-3-pentylpyridine-2-carboxylate Traditional Name: 3-amyl-5-[[4-(2-methylpentanoylamino)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=C(C=C2)NC(=O)C(C)CCC)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O6S/c1-4-6-7-9-17-14-18(15-25-21(17)24(30)31)23(29)27-34(32,33)20-12-10-19(11-13-20)26-22(28)16(3)8-5-2/h10-16H,4-9H2,1-3H3,(H,26,28)(H,27,29)(H,30,31)/p-1