[2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: [2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-(thiophen-2-ylsulfonylamino)benzoate Openeye Name: [2-(2,5-dimethoxyanilino)-2-oxo-ethyl] 2-(2-thienylsulfonylamino)benzoate CAS Name: 2-(thiophen-2-ylsulfonylamino)benzoic acid [2-(2,5-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethoxyanilino)-2-oxoethyl] 2-(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 2-(2-thienylsulfonylamino)benzoic acid [2-(2,5-dimethoxyanilino)-2-keto-ethyl] ester Formula: C21H20N2O7S2 MolecularWeight: 476.5227

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H20N2O7S2/c1-28-14-9-10-18(29-2)17(12-14)22-19(24)13-30-21(25)15-6-3-4-7-16(15)23-32(26,27)20-8-5-11-31-20/h3-12,23H,13H2,1-2H3,(H,22,24)