2-[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: 2-[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Openeye Name: 2-[[3-cyano-6-(p-tolyl)-2-pyridyl]sulfanyl]-N-(4-sulfamoylphenyl)propanamide CAS Name: 2-[[3-cyano-6-(4-methylphenyl)-2-pyridinyl]thio]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: 2-[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(4-sulfamoylphenyl)propanamide Traditional Name: 2-[[3-cyano-6-(p-tolyl)-2-pyridyl]thio]-N-(4-sulfamoylphenyl)propionamide Formula: C22H20N4O3S2 MolecularWeight: 452.5492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C22H20N4O3S2/c1-14-3-5-16(6-4-14)20-12-7-17(13-23)22(26-20)30-15(2)21(27)25-18-8-10-19(11-9-18)31(24,28)29/h3-12,15H,1-2H3,(H,25,27)(H2,24,28,29)