4-bromanyl-N-[[1-[(4-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[[1-[(4-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-bromo-N-isopropyl-N-[[1-(p-tolylmethyl)pyrrol-2-yl]methyl]benzenesulfonamide CAS Name: 4-bromo-N-[[1-[(4-methylphenyl)methyl]-2-pyrrolyl]methyl]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-bromo-N-[[1-[(4-methylphenyl)methyl]pyrrol-2-yl]methyl]-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-bromo-N-isopropyl-N-[[1-(4-methylbenzyl)pyrrol-2-yl]methyl]benzenesulfonamide Formula: C22H25BrN2O2S MolecularWeight: 461.4151

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=CC=C2CN(C(C)C)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=CC=C2CN(C(C)C)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H25BrN2O2S/c1-17(2)25(28(26,27)22-12-10-20(23)11-13-22)16-21-5-4-14-24(21)15-19-8-6-18(3)7-9-19/h4-14,17H,15-16H2,1-3H3