[2-[[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl] (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate

Systemtic Name: [2-[[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl] (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Openeye Name: [2-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)anilino]-2-oxo-ethyl] (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate CAS Name: (E)-3-[3-(trifluoromethyl)phenyl]-2-propenoic acid [2-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[3-(3,4-dihydro-2H-pyrrol-5-ylsulfamoyl)anilino]-2-oxoethyl] (E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3-(trifluoromethyl)phenyl]acrylic acid [2-keto-2-[3-(1-pyrrolin-2-ylsulfamoyl)anilino]ethyl] ester Formula: C22H20F3N3O5S MolecularWeight: 495.47151

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=NC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)COC(=O)C=CC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CC(=NC1)NS(=O)(=O)C2=CC=CC(=C2)NC(=O)COC(=O)/C=C/C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C22H20F3N3O5S/c23-22(24,25)16-5-1-4-15(12-16)9-10-21(30)33-14-20(29)27-17-6-2-7-18(13-17)34(31,32)28-19-8-3-11-26-19/h1-2,4-7,9-10,12-13H,3,8,11,14H2,(H,26,28)(H,27,29)/b10-9+