N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-morpholin-4-yl-5-sulfamoyl-benzamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-morpholin-4-yl-5-sulfamoyl-benzamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-morpholino-5-sulfamoyl-benzamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-(4-morpholinyl)-5-sulfamoylbenzamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-morpholin-4-yl-5-sulfamoylbenzamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-morpholino-5-sulfamoyl-benzamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)N4CCOCC4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N)N4CCOCC4)C

InChI

InChI=1S/C20H22N4O4S2/c1-12-9-13(2)18-17(10-12)29-20(22-18)23-19(25)15-11-14(30(21,26)27)3-4-16(15)24-5-7-28-8-6-24/h3-4,9-11H,5-8H2,1-2H3,(H2,21,26,27)(H,22,23,25)