methyl 2-[2-[(4-fluorophenyl)-thiophen-2-ylsulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 2-[2-[(4-fluorophenyl)-thiophen-2-ylsulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 2-[[2-[4-fluoro-N-(2-thienylsulfonyl)anilino]acetyl]amino]benzoate CAS Name: 2-[[2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 2-[[2-[4-fluoro-N-(2-thienylsulfonyl)anilino]acetyl]amino]benzoic acid methyl ester Formula: C20H17FN2O5S2 MolecularWeight: 448.487783

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H17FN2O5S2/c1-28-20(25)16-5-2-3-6-17(16)22-18(24)13-23(15-10-8-14(21)9-11-15)30(26,27)19-7-4-12-29-19/h2-12H,13H2,1H3,(H,22,24)