4-tert-butyl-N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[4-[4-(3,3-dimethyl-1-oxobutyl)-1-piperazinyl]phenyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[4-[4-(3,3-dimethylbutanoyl)piperazin-1-yl]phenyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[4-[4-(3,3-dimethylbutanoyl)piperazino]phenyl]benzenesulfonamide Formula: C26H37N3O3S MolecularWeight: 471.65528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C)(C)CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H37N3O3S/c1-25(2,3)19-24(30)29-17-15-28(16-18-29)22-11-9-21(10-12-22)27-33(31,32)23-13-7-20(8-14-23)26(4,5)6/h7-14,27H,15-19H2,1-6H3