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

Systemtic Name: 2-(6-butyl-3-cyano-pyridin-2-yl)sulfanyl-N-[4-[(6-chloranylpyridazin-3-yl)sulfamoyl]phenyl]ethanamide Openeye Name: 2-[(6-butyl-3-cyano-2-pyridyl)sulfanyl]-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]acetamide CAS Name: 2-[(6-butyl-3-cyano-2-pyridinyl)thio]-N-[4-[(6-chloro-3-pyridazinyl)sulfamoyl]phenyl]acetamide IUPAC Name: 2-(6-butyl-3-cyanopyridin-2-yl)sulfanyl-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]acetamide Traditional Name: 2-[(6-butyl-3-cyano-2-pyridyl)thio]-N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]acetamide Formula: C22H21ClN6O3S2 MolecularWeight: 517.02354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C=C1)C#N)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NN=C(C=C3)Cl

Isomeric SMILES

CCCCC1=NC(=C(C=C1)C#N)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NN=C(C=C3)Cl

InChI

InChI=1S/C22H21ClN6O3S2/c1-2-3-4-16-6-5-15(13-24)22(26-16)33-14-21(30)25-17-7-9-18(10-8-17)34(31,32)29-20-12-11-19(23)27-28-20/h5-12H,2-4,14H2,1H3,(H,25,30)(H,28,29)