2-chloranyl-N-(4-chlorophenyl)-5-[4-(3-methylbutanoyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: 2-chloranyl-N-(4-chlorophenyl)-5-[4-(3-methylbutanoyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 2-chloro-N-(4-chlorophenyl)-5-[4-(3-methylbutanoyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: 2-chloro-N-(4-chlorophenyl)-5-[[4-(3-methyl-1-oxobutyl)-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: 2-chloro-N-(4-chlorophenyl)-5-[4-(3-methylbutanoyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: 2-chloro-N-(4-chlorophenyl)-5-(4-isovalerylpiperazine-1-carbonyl)benzenesulfonamide Formula: C22H25Cl2N3O4S MolecularWeight: 498.4226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25Cl2N3O4S/c1-15(2)13-21(28)26-9-11-27(12-10-26)22(29)16-3-8-19(24)20(14-16)32(30,31)25-18-6-4-17(23)5-7-18/h3-8,14-15,25H,9-13H2,1-2H3