[2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl] 5-(diethylsulfamoyl)-2-oxidanyl-benzoate

Systemtic Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxidanylidene-ethyl] 5-(diethylsulfamoyl)-2-oxidanyl-benzoate Openeye Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxo-ethyl] 5-(diethylsulfamoyl)-2-hydroxy-benzoate CAS Name: 5-(diethylsulfamoyl)-2-hydroxybenzoic acid [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzothiazol-2-ylamino)-2-oxoethyl] 5-(diethylsulfamoyl)-2-hydroxybenzoate Traditional Name: 5-(diethylsulfamoyl)-2-hydroxy-benzoic acid [2-(1,3-benzothiazol-2-ylamino)-2-keto-ethyl] ester Formula: C20H21N3O6S2 MolecularWeight: 463.52724

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)O)C(=O)OCC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)O)C(=O)OCC(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H21N3O6S2/c1-3-23(4-2)31(27,28)13-9-10-16(24)14(11-13)19(26)29-12-18(25)22-20-21-15-7-5-6-8-17(15)30-20/h5-11,24H,3-4,12H2,1-2H3,(H,21,22,25)