1,3-benzothiazol-2-ylmethyl 3-(diethylsulfamoyl)-4-methoxy-benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-(diethylsulfamoyl)-4-methoxy-benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-(diethylsulfamoyl)-4-methoxy-benzoate CAS Name: 3-(diethylsulfamoyl)-4-methoxybenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-(diethylsulfamoyl)-4-methoxybenzoate Traditional Name: 3-(diethylsulfamoyl)-4-methoxy-benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C20H22N2O5S2 MolecularWeight: 434.52908

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3S2)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCC2=NC3=CC=CC=C3S2)OC

InChI

InChI=1S/C20H22N2O5S2/c1-4-22(5-2)29(24,25)18-12-14(10-11-16(18)26-3)20(23)27-13-19-21-15-8-6-7-9-17(15)28-19/h6-12H,4-5,13H2,1-3H3