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

Systemtic Name: 4-[3-[2-(2-cyanophenoxy)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide Openeye Name: 4-[3-[2-(2-cyanophenoxy)acetyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide CAS Name: 4-[3-[2-(2-cyanophenoxy)-1-oxoethyl]-2,5-dimethyl-1-pyrrolyl]benzenesulfonamide IUPAC Name: 4-[3-[2-(2-cyanophenoxy)acetyl]-2,5-dimethylpyrrol-1-yl]benzenesulfonamide Traditional Name: 4-[3-[2-(2-cyanophenoxy)acetyl]-2,5-dimethyl-pyrrol-1-yl]benzenesulfonamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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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)COC3=CC=CC=C3C#N

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)COC3=CC=CC=C3C#N

InChI

InChI=1S/C21H19N3O4S/c1-14-11-19(20(25)13-28-21-6-4-3-5-16(21)12-22)15(2)24(14)17-7-9-18(10-8-17)29(23,26)27/h3-11H,13H2,1-2H3,(H2,23,26,27)