dimethyl 2-[(2-morpholin-4-yl-1,3-benzothiazol-6-yl)sulfamoyl]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[(2-morpholin-4-yl-1,3-benzothiazol-6-yl)sulfamoyl]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[(2-morpholino-1,3-benzothiazol-6-yl)sulfamoyl]benzene-1,4-dicarboxylate CAS Name: 2-[[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]sulfamoyl]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(2-morpholin-4-yl-1,3-benzothiazol-6-yl)sulfamoyl]benzene-1,4-dicarboxylate Traditional Name: 2-[(2-morpholino-1,3-benzothiazol-6-yl)sulfamoyl]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C21H21N3O7S2 MolecularWeight: 491.53734

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4

InChI

InChI=1S/C21H21N3O7S2/c1-29-19(25)13-3-5-15(20(26)30-2)18(11-13)33(27,28)23-14-4-6-16-17(12-14)32-21(22-16)24-7-9-31-10-8-24/h3-6,11-12,23H,7-10H2,1-2H3