4-tert-butyl-N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[4-(4-o-toluoylpiperazino)phenyl]benzenesulfonamide Formula: C28H33N3O3S MolecularWeight: 491.64492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C28H33N3O3S/c1-21-7-5-6-8-26(21)27(32)31-19-17-30(18-20-31)24-13-11-23(12-14-24)29-35(33,34)25-15-9-22(10-16-25)28(2,3)4/h5-16,29H,17-20H2,1-4H3