4-[2,5-dimethyl-3-[2-[methyl-(phenylmethyl)amino]ethanoyl]pyrrol-1-yl]benzenesulfonamide

Systemtic Name: 4-[2,5-dimethyl-3-[2-[methyl-(phenylmethyl)amino]ethanoyl]pyrrol-1-yl]benzenesulfonamide Openeye Name: 4-[3-[2-[benzyl(methyl)amino]acetyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide CAS Name: 4-[2,5-dimethyl-3-[2-[methyl-(phenylmethyl)amino]-1-oxoethyl]-1-pyrrolyl]benzenesulfonamide IUPAC Name: 4-[3-[2-[benzyl(methyl)amino]acetyl]-2,5-dimethylpyrrol-1-yl]benzenesulfonamide Traditional Name: 4-[3-[2-[benzyl(methyl)amino]acetyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)CN(C)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)CN(C)CC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O3S/c1-16-13-21(22(26)15-24(3)14-18-7-5-4-6-8-18)17(2)25(16)19-9-11-20(12-10-19)29(23,27)28/h4-13H,14-15H2,1-3H3,(H2,23,27,28)