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

Systemtic Name: [2-(diethylamino)-1,3-benzothiazol-6-yl] 4-[methyl-(phenylmethyl)sulfamoyl]benzoate Openeye Name: [2-(diethylamino)-1,3-benzothiazol-6-yl] 4-[benzyl(methyl)sulfamoyl]benzoate CAS Name: 4-[methyl-(phenylmethyl)sulfamoyl]benzoic acid [2-(diethylamino)-1,3-benzothiazol-6-yl] ester IUPAC Name: [2-(diethylamino)-1,3-benzothiazol-6-yl] 4-[benzyl(methyl)sulfamoyl]benzoate Traditional Name: 4-[benzyl(methyl)sulfamoyl]benzoic acid [2-(diethylamino)-1,3-benzothiazol-6-yl] ester Formula: C26H27N3O4S2 MolecularWeight: 509.64028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC2=C(S1)C=C(C=C2)OC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)CC4=CC=CC=C4

Isomeric SMILES

CCN(CC)C1=NC2=C(S1)C=C(C=C2)OC(=O)C3=CC=C(C=C3)S(=O)(=O)N(C)CC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O4S2/c1-4-29(5-2)26-27-23-16-13-21(17-24(23)34-26)33-25(30)20-11-14-22(15-12-20)35(31,32)28(3)18-19-9-7-6-8-10-19/h6-17H,4-5,18H2,1-3H3