[2-[2,5-dimethyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]-2-oxidanylidene-ethyl] 2-(phenylsulfonylamino)ethanoate

Systemtic Name: [2-[2,5-dimethyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]-2-oxidanylidene-ethyl] 2-(phenylsulfonylamino)ethanoate Openeye Name: [2-[2,5-dimethyl-1-[2-(2-thienyl)ethyl]pyrrol-3-yl]-2-oxo-ethyl] 2-(benzenesulfonamido)acetate CAS Name: 2-(benzenesulfonamido)acetic acid [2-[2,5-dimethyl-1-(2-thiophen-2-ylethyl)-3-pyrrolyl]-2-oxoethyl] ester IUPAC Name: [2-[2,5-dimethyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]-2-oxoethyl] 2-(benzenesulfonamido)acetate Traditional Name: 2-(benzenesulfonamido)acetic acid [2-[2,5-dimethyl-1-[2-(2-thienyl)ethyl]pyrrol-3-yl]-2-keto-ethyl] ester Formula: C22H24N2O5S2 MolecularWeight: 460.56636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CS2)C)C(=O)COC(=O)CNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CS2)C)C(=O)COC(=O)CNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H24N2O5S2/c1-16-13-20(17(2)24(16)11-10-18-7-6-12-30-18)21(25)15-29-22(26)14-23-31(27,28)19-8-4-3-5-9-19/h3-9,12-13,23H,10-11,14-15H2,1-2H3