methyl 2-[2-[(4-fluorophenyl)-thiophen-2-ylsulfonyl-amino]ethanoylamino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[2-[(4-fluorophenyl)-thiophen-2-ylsulfonyl-amino]ethanoylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[[2-[4-fluoro-N-(2-thienylsulfonyl)anilino]acetyl]amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)-1-oxoethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)acetyl]amino]-4,5-dimethoxybenzoate Traditional Name: 2-[[2-[4-fluoro-N-(2-thienylsulfonyl)anilino]acetyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C22H21FN2O7S2 MolecularWeight: 508.539743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CN(C2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3)OC

InChI

InChI=1S/C22H21FN2O7S2/c1-30-18-11-16(22(27)32-3)17(12-19(18)31-2)24-20(26)13-25(15-8-6-14(23)7-9-15)34(28,29)21-5-4-10-33-21/h4-12H,13H2,1-3H3,(H,24,26)