[2-[[4-[butyl(methyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] pyridine-3-carboxylate

Systemtic Name: [2-[[4-[butyl(methyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] pyridine-3-carboxylate Openeye Name: [2-[4-[butyl(methyl)sulfamoyl]anilino]-2-oxo-ethyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-[4-[butyl(methyl)sulfamoyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-[butyl(methyl)sulfamoyl]anilino]-2-oxoethyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-[4-[butyl(methyl)sulfamoyl]anilino]-2-keto-ethyl] ester Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CN=CC=C2

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CN=CC=C2

InChI

InChI=1S/C19H23N3O5S/c1-3-4-12-22(2)28(25,26)17-9-7-16(8-10-17)21-18(23)14-27-19(24)15-6-5-11-20-13-15/h5-11,13H,3-4,12,14H2,1-2H3,(H,21,23)