4-fluoranyl-N-(2-methylpropyl)-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-(2-methylpropyl)-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]benzenesulfonamide Openeye Name: N-[(1-benzylpyrrol-2-yl)methyl]-4-fluoro-N-isobutyl-benzenesulfonamide CAS Name: 4-fluoro-N-(2-methylpropyl)-N-[[1-(phenylmethyl)-2-pyrrolyl]methyl]benzenesulfonamide IUPAC Name: N-[(1-benzylpyrrol-2-yl)methyl]-4-fluoro-N-(2-methylpropyl)benzenesulfonamide Traditional Name: N-[(1-benzylpyrrol-2-yl)methyl]-4-fluoro-N-isobutyl-benzenesulfonamide Formula: C22H25FN2O2S MolecularWeight: 400.509503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=CN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CN(CC1=CC=CN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN2O2S/c1-18(2)15-25(28(26,27)22-12-10-20(23)11-13-22)17-21-9-6-14-24(21)16-19-7-4-3-5-8-19/h3-14,18H,15-17H2,1-2H3