3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]-4,5-dimethyl-benzoate

Systemtic Name: 3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]-4,5-dimethyl-benzoate Openeye Name: 3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]-4,5-dimethyl-benzoate CAS Name: 3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]-4,5-dimethylbenzoate IUPAC Name: 3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]-4,5-dimethylbenzoate Traditional Name: 3-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfamoyl]-4,5-dimethyl-benzoate Formula: C18H17N2O5S2- MolecularWeight: 405.46798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC(=CC(=C3C)C)C(=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CC(=CC(=C3C)C)C(=O)[O-]

InChI

InChI=1S/C18H18N2O5S2/c1-4-25-13-5-6-14-15(9-13)26-18(19-14)20-27(23,24)16-8-12(17(21)22)7-10(2)11(16)3/h5-9H,4H2,1-3H3,(H,19,20)(H,21,22)/p-1