2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)butanamide

Systemtic Name: 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)butanamide Openeye Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-(4-sulfamoylphenyl)butanamide CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-N-(4-sulfamoylphenyl)butanamide IUPAC Name: 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)butanamide Traditional Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]-N-(4-sulfamoylphenyl)butyramide Formula: C18H20N4O3S2 MolecularWeight: 404.5064

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=C(C(=CC(=N2)C)C)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=C(C(=CC(=N2)C)C)C#N

InChI

InChI=1S/C18H20N4O3S2/c1-4-16(26-18-15(10-19)11(2)9-12(3)21-18)17(23)22-13-5-7-14(8-6-13)27(20,24)25/h5-9,16H,4H2,1-3H3,(H,22,23)(H2,20,24,25)