pentan-3-yl 5-[[3-(hexylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: pentan-3-yl 5-[[3-(hexylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: 1-ethylpropyl 5-[[3-(hexylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[[[3-[(hexylamino)-oxomethyl]phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylic acid pentan-3-yl ester IUPAC Name: pentan-3-yl 5-[[3-(hexylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[3-(hexylcarbamoyl)phenyl]sulfonylcarbamoyl]picolinic acid 1-ethylpropyl ester Formula: C25H33N3O6S MolecularWeight: 503.61102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)OC(CC)CC

Isomeric SMILES

CCCCCCNC(=O)C1=CC(=CC=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)OC(CC)CC

InChI

InChI=1S/C25H33N3O6S/c1-4-7-8-9-15-26-23(29)18-11-10-12-21(16-18)35(32,33)28-24(30)19-13-14-22(27-17-19)25(31)34-20(5-2)6-3/h10-14,16-17,20H,4-9,15H2,1-3H3,(H,26,29)(H,28,30)