methyl 4-[(2-morpholin-4-yl-1,3-benzothiazol-6-yl)sulfamoyl]benzoate

Systemtic Name: methyl 4-[(2-morpholin-4-yl-1,3-benzothiazol-6-yl)sulfamoyl]benzoate Openeye Name: methyl 4-[(2-morpholino-1,3-benzothiazol-6-yl)sulfamoyl]benzoate CAS Name: 4-[[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-morpholin-4-yl-1,3-benzothiazol-6-yl)sulfamoyl]benzoate Traditional Name: 4-[(2-morpholino-1,3-benzothiazol-6-yl)sulfamoyl]benzoic acid methyl ester Formula: C19H19N3O5S2 MolecularWeight: 433.50126

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O5S2/c1-26-18(23)13-2-5-15(6-3-13)29(24,25)21-14-4-7-16-17(12-14)28-19(20-16)22-8-10-27-11-9-22/h2-7,12,21H,8-11H2,1H3