methyl 5-[[4-(2-cyclohexylethanoylamino)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: methyl 5-[[4-(2-cyclohexylethanoylamino)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: methyl 5-[[4-[(2-cyclohexylacetyl)amino]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[[[4-[(2-cyclohexyl-1-oxoethyl)amino]phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(2-cyclohexylacetyl)amino]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[4-[(2-cyclohexylacetyl)amino]phenyl]sulfonylcarbamoyl]picolinic acid methyl ester Formula: C22H25N3O6S MolecularWeight: 459.5154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3CCCCC3

Isomeric SMILES

COC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3CCCCC3

InChI

InChI=1S/C22H25N3O6S/c1-31-22(28)19-12-7-16(14-23-19)21(27)25-32(29,30)18-10-8-17(9-11-18)24-20(26)13-15-5-3-2-4-6-15/h7-12,14-15H,2-6,13H2,1H3,(H,24,26)(H,25,27)