4-tert-butyl-N-[4-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)phenyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[4-(4-naphthalen-2-ylcarbonylpiperazin-1-yl)phenyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[4-[4-(naphthalene-2-carbonyl)piperazin-1-yl]phenyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[4-[4-[2-naphthalenyl(oxo)methyl]-1-piperazinyl]phenyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[4-[4-(naphthalene-2-carbonyl)piperazin-1-yl]phenyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[4-[4-(2-naphthoyl)piperazino]phenyl]benzenesulfonamide Formula: C31H33N3O3S MolecularWeight: 527.67702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C31H33N3O3S/c1-31(2,3)26-10-16-29(17-11-26)38(36,37)32-27-12-14-28(15-13-27)33-18-20-34(21-19-33)30(35)25-9-8-23-6-4-5-7-24(23)22-25/h4-17,22,32H,18-21H2,1-3H3