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

Systemtic Name: methyl 3-[(2-morpholin-4-yl-1,3-benzothiazol-6-yl)sulfamoyl]thiophene-2-carboxylate Openeye Name: methyl 3-[(2-morpholino-1,3-benzothiazol-6-yl)sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]sulfamoyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2-morpholin-4-yl-1,3-benzothiazol-6-yl)sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[(2-morpholino-1,3-benzothiazol-6-yl)sulfamoyl]thiophene-2-carboxylic acid methyl ester Formula: C17H17N3O5S3 MolecularWeight: 439.52898

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4

Isomeric SMILES

COC(=O)C1=C(C=CS1)S(=O)(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCOCC4

InChI

InChI=1S/C17H17N3O5S3/c1-24-16(21)15-14(4-9-26-15)28(22,23)19-11-2-3-12-13(10-11)27-17(18-12)20-5-7-25-8-6-20/h2-4,9-10,19H,5-8H2,1H3