3-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: 3-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)propanamide Openeye Name: 3-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]-N-(4-sulfamoylphenyl)propanamide CAS Name: 3-[(6-butyl-3-cyano-2-pyridinyl)thio]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: 3-(6-butyl-3-cyanopyridin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)propanamide Traditional Name: 3-[(6-butyl-3-cyano-2-pyridyl)thio]-N-(4-sulfamoylphenyl)propionamide Formula: C19H22N4O3S2 MolecularWeight: 418.53298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C19H22N4O3S2/c1-2-3-4-15-6-5-14(13-20)19(23-15)27-12-11-18(24)22-16-7-9-17(10-8-16)28(21,25)26/h5-10H,2-4,11-12H2,1H3,(H,22,24)(H2,21,25,26)