4-tert-butyl-N-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[[1-[(4-chlorophenyl)methyl]-2-pyrrolyl]methyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[[1-(4-chlorobenzyl)pyrrol-2-yl]methyl]benzenesulfonamide Formula: C22H25ClN2O2S MolecularWeight: 416.9641

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CN2CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CN2CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN2O2S/c1-22(2,3)18-8-12-21(13-9-18)28(26,27)24-15-20-5-4-14-25(20)16-17-6-10-19(23)11-7-17/h4-14,24H,15-16H2,1-3H3