4-[4-(3,3-dimethylbutyl)piperazin-1-yl]carbonyl-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[4-(3,3-dimethylbutyl)piperazin-1-yl]carbonyl-N,N-diethyl-benzenesulfonamide Openeye Name: 4-[4-(3,3-dimethylbutyl)piperazine-1-carbonyl]-N,N-diethyl-benzenesulfonamide CAS Name: 4-[[4-(3,3-dimethylbutyl)-1-piperazinyl]-oxomethyl]-N,N-diethylbenzenesulfonamide IUPAC Name: 4-[4-(3,3-dimethylbutyl)piperazine-1-carbonyl]-N,N-diethylbenzenesulfonamide Traditional Name: 4-[4-(3,3-dimethylbutyl)piperazine-1-carbonyl]-N,N-diethyl-benzenesulfonamide Formula: C21H35N3O3S MolecularWeight: 409.5859

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CCC(C)(C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)CCC(C)(C)C

InChI

InChI=1S/C21H35N3O3S/c1-6-24(7-2)28(26,27)19-10-8-18(9-11-19)20(25)23-16-14-22(15-17-23)13-12-21(3,4)5/h8-11H,6-7,12-17H2,1-5H3