4-tert-butyl-N-[[4-(4-phenylpiperazin-1-yl)carbonylphenyl]methyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[[4-(4-phenylpiperazin-1-yl)carbonylphenyl]methyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[[4-(4-phenylpiperazine-1-carbonyl)phenyl]methyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[[4-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]methyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[[4-(4-phenylpiperazine-1-carbonyl)phenyl]methyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[4-(4-phenylpiperazine-1-carbonyl)benzyl]benzenesulfonamide Formula: C28H33N3O3S MolecularWeight: 491.64492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C28H33N3O3S/c1-28(2,3)24-13-15-26(16-14-24)35(33,34)29-21-22-9-11-23(12-10-22)27(32)31-19-17-30(18-20-31)25-7-5-4-6-8-25/h4-16,29H,17-21H2,1-3H3