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

Systemtic Name: methyl 5-[[2-chloranyl-4-(phenethylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: methyl 5-[[2-chloro-4-(phenethylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[[[2-chloro-4-[oxo-(phenethylamino)methyl]phenyl]sulfonylamino]-oxomethyl]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-chloro-4-(phenethylcarbamoyl)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[[2-chloro-4-(phenethylcarbamoyl)phenyl]sulfonylcarbamoyl]picolinic acid methyl ester Formula: C23H20ClN3O6S MolecularWeight: 501.9394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)C2=C(C=C(C=C2)C(=O)NCCC3=CC=CC=C3)Cl

Isomeric SMILES

COC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)C2=C(C=C(C=C2)C(=O)NCCC3=CC=CC=C3)Cl

InChI

InChI=1S/C23H20ClN3O6S/c1-33-23(30)19-9-7-17(14-26-19)22(29)27-34(31,32)20-10-8-16(13-18(20)24)21(28)25-12-11-15-5-3-2-4-6-15/h2-10,13-14H,11-12H2,1H3,(H,25,28)(H,27,29)