methyl 6-[[3-(butylsulfamoyl)phenyl]carbamoyl]pyridine-3-carboxylate

Systemtic Name: methyl 6-[[3-(butylsulfamoyl)phenyl]carbamoyl]pyridine-3-carboxylate Openeye Name: methyl 6-[[3-(butylsulfamoyl)phenyl]carbamoyl]pyridine-3-carboxylate CAS Name: 6-[[3-(butylsulfamoyl)anilino]-oxomethyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[[3-(butylsulfamoyl)phenyl]carbamoyl]pyridine-3-carboxylate Traditional Name: 6-[[3-(butylsulfamoyl)phenyl]carbamoyl]nicotinic acid methyl ester Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC=CC(=C1)NC(=O)C2=NC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC=CC(=C1)NC(=O)C2=NC=C(C=C2)C(=O)OC

InChI

InChI=1S/C18H21N3O5S/c1-3-4-10-20-27(24,25)15-7-5-6-14(11-15)21-17(22)16-9-8-13(12-19-16)18(23)26-2/h5-9,11-12,20H,3-4,10H2,1-2H3,(H,21,22)