4-chloranyl-N-[2-[4-(3-methylbutanoyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[2-[4-(3-methylbutanoyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-4-chloro-N-[2-[4-(3-methylbutanoyl)piperazin-1-yl]-2-oxo-ethyl]benzenesulfonamide CAS Name: 4-chloro-N-[2-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]-2-oxoethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-4-chloro-N-[2-[4-(3-methylbutanoyl)piperazin-1-yl]-2-oxoethyl]benzenesulfonamide Traditional Name: N-benzyl-4-chloro-N-[2-(4-isovalerylpiperazino)-2-keto-ethyl]benzenesulfonamide Formula: C24H30ClN3O4S MolecularWeight: 492.0307

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCN(CC1)C(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)CC(=O)N1CCN(CC1)C(=O)CN(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H30ClN3O4S/c1-19(2)16-23(29)26-12-14-27(15-13-26)24(30)18-28(17-20-6-4-3-5-7-20)33(31,32)22-10-8-21(25)9-11-22/h3-11,19H,12-18H2,1-2H3