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

Systemtic Name: N-[4-[(6-chloranylpyridazin-3-yl)sulfamoyl]phenyl]-2-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-(p-tolylsulfanyl)butanamide CAS Name: N-[4-[(6-chloro-3-pyridazinyl)sulfamoyl]phenyl]-2-[(4-methylphenyl)thio]butanamide IUPAC Name: N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-[4-[(6-chloropyridazin-3-yl)sulfamoyl]phenyl]-2-(p-tolylthio)butyramide Formula: C21H21ClN4O3S2 MolecularWeight: 476.99944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NN=C(C=C2)Cl)SC3=CC=C(C=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NN=C(C=C2)Cl)SC3=CC=C(C=C3)C

InChI

InChI=1S/C21H21ClN4O3S2/c1-3-18(30-16-8-4-14(2)5-9-16)21(27)23-15-6-10-17(11-7-15)31(28,29)26-20-13-12-19(22)24-25-20/h4-13,18H,3H2,1-2H3,(H,23,27)(H,25,26)