heptan-4-yl 5-[[4-(dibutylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: heptan-4-yl 5-[[4-(dibutylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: 1-propylbutyl 5-[[4-(dibutylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[[[4-[(dibutylamino)-oxomethyl]phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylic acid heptan-4-yl ester IUPAC Name: heptan-4-yl 5-[[4-(dibutylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[4-(dibutylcarbamoyl)phenyl]sulfonylcarbamoyl]picolinic acid 1-propylbutyl ester Formula: C29H41N3O6S MolecularWeight: 559.71734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)C1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)OC(CCC)CCC

Isomeric SMILES

CCCCN(CCCC)C(=O)C1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)OC(CCC)CCC

InChI

InChI=1S/C29H41N3O6S/c1-5-9-19-32(20-10-6-2)28(34)22-13-16-25(17-14-22)39(36,37)31-27(33)23-15-18-26(30-21-23)29(35)38-24(11-7-3)12-8-4/h13-18,21,24H,5-12,19-20H2,1-4H3,(H,31,33)