ethyl (5E)-5-[[5-[[(4-bromophenyl)sulfonylamino]methyl]furan-2-yl]methylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl (5E)-5-[[5-[[(4-bromophenyl)sulfonylamino]methyl]furan-2-yl]methylidene]-2-methyl-4-oxidanylidene-1H-pyrrole-3-carboxylate Openeye Name: ethyl (5E)-5-[[5-[[(4-bromophenyl)sulfonylamino]methyl]-2-furyl]methylene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate CAS Name: (5E)-5-[[5-[[(4-bromophenyl)sulfonylamino]methyl]-2-furanyl]methylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5E)-5-[[5-[[(4-bromophenyl)sulfonylamino]methyl]furan-2-yl]methylidene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate Traditional Name: (5E)-5-[[5-[(brosylamino)methyl]-2-furyl]methylene]-4-keto-2-methyl-2-pyrroline-3-carboxylic acid ethyl ester Formula: C20H19BrN2O6S MolecularWeight: 495.34366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=CC2=CC=C(O2)CNS(=O)(=O)C3=CC=C(C=C3)Br)C1=O)C

Isomeric SMILES

CCOC(=O)C1=C(N/C(=C/C2=CC=C(O2)CNS(=O)(=O)C3=CC=C(C=C3)Br)/C1=O)C

InChI

InChI=1S/C20H19BrN2O6S/c1-3-28-20(25)18-12(2)23-17(19(18)24)10-14-6-7-15(29-14)11-22-30(26,27)16-8-4-13(21)5-9-16/h4-10,22-23H,3,11H2,1-2H3/b17-10+