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

Systemtic Name: methyl 5-[[4-(butanoylamino)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Openeye Name: methyl 5-[[4-(butanoylamino)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate CAS Name: 5-[oxo-[[4-(1-oxobutylamino)phenyl]sulfonylamino]methyl]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(butanoylamino)phenyl]sulfonylcarbamoyl]pyridine-2-carboxylate Traditional Name: 5-[(4-butyramidophenyl)sulfonylcarbamoyl]picolinic acid methyl ester Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)OC

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CN=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H19N3O6S/c1-3-4-16(22)20-13-6-8-14(9-7-13)28(25,26)21-17(23)12-5-10-15(19-11-12)18(24)27-2/h5-11H,3-4H2,1-2H3,(H,20,22)(H,21,23)