2-(pyridin-4-ylmethylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide

Systemtic Name: 2-(pyridin-4-ylmethylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide Openeye Name: 2-(4-pyridylmethylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide CAS Name: 2-(pyridin-4-ylmethylamino)-N-[2-(4-sulfamoylphenyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 2-(pyridin-4-ylmethylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-3-carboxamide Traditional Name: 2-(4-pyridylmethylamino)-N-[2-(4-sulfamoylphenyl)ethyl]nicotinamide Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)NCC2=CC=NC=C2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC(=C(N=C1)NCC2=CC=NC=C2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H21N5O3S/c21-29(27,28)17-5-3-15(4-6-17)9-13-24-20(26)18-2-1-10-23-19(18)25-14-16-7-11-22-12-8-16/h1-8,10-12H,9,13-14H2,(H,23,25)(H,24,26)(H2,21,27,28)