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

Systemtic Name: heptan-4-yl 5-[[4-(cyclohexylcarbonylamino)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: 1-propylbutyl 5-[[4-(cyclohexanecarbonylamino)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[[[4-[[cyclohexyl(oxo)methyl]amino]phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylic acid heptan-4-yl ester IUPAC Name: heptan-4-yl 5-[[4-(cyclohexanecarbonylamino)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[4-(cyclohexanecarbonylamino)phenyl]sulfonylcarbamoyl]picolinic acid 1-propylbutyl ester Formula: C27H35N3O6S MolecularWeight: 529.6483

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)OC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCCCC3

Isomeric SMILES

CCCC(CCC)OC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCCCC3

InChI

InChI=1S/C27H35N3O6S/c1-3-8-22(9-4-2)36-27(33)24-17-12-20(18-28-24)26(32)30-37(34,35)23-15-13-21(14-16-23)29-25(31)19-10-6-5-7-11-19/h12-19,22H,3-11H2,1-2H3,(H,29,31)(H,30,32)