2-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]ethanamide

Systemtic Name: 2-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]ethanamide Openeye Name: 2-[(3-cyano-6-propyl-2-pyridyl)sulfanyl]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide CAS Name: 2-[(3-cyano-6-propyl-2-pyridinyl)thio]-N-[4-[(4-methyl-2-pyrimidinyl)sulfamoyl]phenyl]acetamide IUPAC Name: 2-(3-cyano-6-propylpyridin-2-yl)sulfanyl-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide Traditional Name: 2-[(3-cyano-6-propyl-2-pyridyl)thio]-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide Formula: C22H22N6O3S2 MolecularWeight: 482.57848

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(C=C1)C#N)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC(=N3)C

Isomeric SMILES

CCCC1=NC(=C(C=C1)C#N)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC(=N3)C

InChI

InChI=1S/C22H22N6O3S2/c1-3-4-17-6-5-16(13-23)21(27-17)32-14-20(29)26-18-7-9-19(10-8-18)33(30,31)28-22-24-12-11-15(2)25-22/h5-12H,3-4,14H2,1-2H3,(H,26,29)(H,24,25,28)