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

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-(diethylsulfamoyl)-4-methyl-benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-(diethylsulfamoyl)-4-methyl-benzoate CAS Name: 3-(diethylsulfamoyl)-4-methylbenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-(diethylsulfamoyl)-4-methylbenzoate Traditional Name: 3-(diethylsulfamoyl)-4-methyl-benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O4S2/c1-4-22(5-2)28(24,25)18-12-15(11-10-14(18)3)20(23)26-13-19-21-16-8-6-7-9-17(16)27-19/h6-12H,4-5,13H2,1-3H3