N-[4-[(6-chloranylpyridazin-3-yl)sulfamoyl]phenyl]-2-cyclohexylsulfanyl-butanamide

Systemtic Name: N-[4-[(6-chloranylpyridazin-3-yl)sulfamoyl]phenyl]-2-cyclohexylsulfanyl-butanamide Openeye Name: N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-cyclohexylsulfanyl-butanamide CAS Name: N-[4-[(6-chloro-3-pyridazinyl)sulfamoyl]phenyl]-2-(cyclohexylthio)butanamide IUPAC Name: N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-cyclohexylsulfanylbutanamide Traditional Name: N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-(cyclohexylthio)butyramide Formula: C20H25ClN4O3S2 MolecularWeight: 469.0205

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NN=C(C=C2)Cl)SC3CCCCC3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NN=C(C=C2)Cl)SC3CCCCC3

InChI

InChI=1S/C20H25ClN4O3S2/c1-2-17(29-15-6-4-3-5-7-15)20(26)22-14-8-10-16(11-9-14)30(27,28)25-19-13-12-18(21)23-24-19/h8-13,15,17H,2-7H2,1H3,(H,22,26)(H,24,25)