dimethyl 5-[2-[(4-fluorophenyl)-thiophen-2-ylsulfonyl-amino]ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-[(4-fluorophenyl)-thiophen-2-ylsulfonyl-amino]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-[4-fluoro-N-(2-thienylsulfonyl)anilino]acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[4-fluoro-N-(2-thienylsulfonyl)anilino]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H19FN2O7S2 MolecularWeight: 506.523863

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C22H19FN2O7S2/c1-31-21(27)14-10-15(22(28)32-2)12-17(11-14)24-19(26)13-25(18-7-5-16(23)6-8-18)34(29,30)20-4-3-9-33-20/h3-12H,13H2,1-2H3,(H,24,26)