[2-[(4-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 4,5-dimethoxy-2-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: [2-[(4-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 4,5-dimethoxy-2-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: [2-(4-morpholinosulfonylanilino)-2-oxo-ethyl] 4,5-dimethoxy-2-(thiophene-2-carbonylamino)benzoate CAS Name: 4,5-dimethoxy-2-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid [2-[4-(4-morpholinylsulfonyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 4,5-dimethoxy-2-(thiophene-2-carbonylamino)benzoate Traditional Name: 4,5-dimethoxy-2-(2-thenoylamino)benzoic acid [2-keto-2-(4-morpholinosulfonylanilino)ethyl] ester Formula: C26H27N3O9S2 MolecularWeight: 589.63728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC=CS4)OC

InChI

InChI=1S/C26H27N3O9S2/c1-35-21-14-19(20(15-22(21)36-2)28-25(31)23-4-3-13-39-23)26(32)38-16-24(30)27-17-5-7-18(8-6-17)40(33,34)29-9-11-37-12-10-29/h3-8,13-15H,9-12,16H2,1-2H3,(H,27,30)(H,28,31)