[2-(dimethylamino)-1,3-benzothiazol-6-yl] 4-[bis(2-methylpropyl)sulfamoyl]benzoate

Systemtic Name: [2-(dimethylamino)-1,3-benzothiazol-6-yl] 4-[bis(2-methylpropyl)sulfamoyl]benzoate Openeye Name: [2-(dimethylamino)-1,3-benzothiazol-6-yl] 4-(diisobutylsulfamoyl)benzoate CAS Name: 4-[bis(2-methylpropyl)sulfamoyl]benzoic acid [2-(dimethylamino)-1,3-benzothiazol-6-yl] ester IUPAC Name: [2-(dimethylamino)-1,3-benzothiazol-6-yl] 4-[bis(2-methylpropyl)sulfamoyl]benzoate Traditional Name: 4-(diisobutylsulfamoyl)benzoic acid [2-(dimethylamino)-1,3-benzothiazol-6-yl] ester Formula: C24H31N3O4S2 MolecularWeight: 489.65064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O4S2/c1-16(2)14-27(15-17(3)4)33(29,30)20-10-7-18(8-11-20)23(28)31-19-9-12-21-22(13-19)32-24(25-21)26(5)6/h7-13,16-17H,14-15H2,1-6H3