cyclohexyl 5-[[4-[(phenylmethyl)carbamoyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate

Systemtic Name: cyclohexyl 5-[[4-[(phenylmethyl)carbamoyl]phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: cyclohexyl 5-[[4-(benzylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[oxo-[[4-[oxo-[(phenylmethyl)amino]methyl]phenyl]sulfonylamino]methyl]-2-pyridinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 5-[[4-(benzylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[4-(benzylcarbamoyl)phenyl]sulfonylcarbamoyl]picolinic acid cyclohexyl ester Formula: C27H27N3O6S MolecularWeight: 521.58478

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=NC=C(C=C2)C(=O)NS(=O)(=O)C3=CC=C(C=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=NC=C(C=C2)C(=O)NS(=O)(=O)C3=CC=C(C=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O6S/c31-25(29-17-19-7-3-1-4-8-19)20-11-14-23(15-12-20)37(34,35)30-26(32)21-13-16-24(28-18-21)27(33)36-22-9-5-2-6-10-22/h1,3-4,7-8,11-16,18,22H,2,5-6,9-10,17H2,(H,29,31)(H,30,32)