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

Systemtic Name: (2-morpholin-4-yl-1,3-benzothiazol-6-yl) 4-[butyl(ethyl)sulfamoyl]benzoate Openeye Name: (2-morpholino-1,3-benzothiazol-6-yl) 4-[butyl(ethyl)sulfamoyl]benzoate CAS Name: 4-[butyl(ethyl)sulfamoyl]benzoic acid [2-(4-morpholinyl)-1,3-benzothiazol-6-yl] ester IUPAC Name: (2-morpholin-4-yl-1,3-benzothiazol-6-yl) 4-[butyl(ethyl)sulfamoyl]benzoate Traditional Name: 4-[butyl(ethyl)sulfamoyl]benzoic acid (2-morpholino-1,3-benzothiazol-6-yl) ester Formula: C24H29N3O5S2 MolecularWeight: 503.63416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)N=C(S3)N4CCOCC4

Isomeric SMILES

CCCCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)N=C(S3)N4CCOCC4

InChI

InChI=1S/C24H29N3O5S2/c1-3-5-12-27(4-2)34(29,30)20-9-6-18(7-10-20)23(28)32-19-8-11-21-22(17-19)33-24(25-21)26-13-15-31-16-14-26/h6-11,17H,3-5,12-16H2,1-2H3