2-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]butanamide

Systemtic Name: 2-(3-cyano-6-methyl-pyridin-2-yl)sulfanyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]butanamide Openeye Name: 2-[(3-cyano-6-methyl-2-pyridyl)sulfanyl]-N-[4-[(5-methylisoxazol-3-yl)sulfamoyl]phenyl]butanamide CAS Name: 2-[(3-cyano-6-methyl-2-pyridinyl)thio]-N-[4-[(5-methyl-3-isoxazolyl)sulfamoyl]phenyl]butanamide IUPAC Name: 2-(3-cyano-6-methylpyridin-2-yl)sulfanyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]butanamide Traditional Name: 2-[(3-cyano-6-methyl-2-pyridyl)thio]-N-[4-[(5-methylisoxazol-3-yl)sulfamoyl]phenyl]butyramide Formula: C21H21N5O4S2 MolecularWeight: 471.55254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NOC(=C2)C)SC3=C(C=CC(=N3)C)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NOC(=C2)C)SC3=C(C=CC(=N3)C)C#N

InChI

InChI=1S/C21H21N5O4S2/c1-4-18(31-21-15(12-22)6-5-13(2)23-21)20(27)24-16-7-9-17(10-8-16)32(28,29)26-19-11-14(3)30-25-19/h5-11,18H,4H2,1-3H3,(H,24,27)(H,25,26)