(2-sulfamoyl-1,3-benzothiazol-6-yl) 4-(dimethylaminomethyl)benzoate

Systemtic Name: (2-sulfamoyl-1,3-benzothiazol-6-yl) 4-(dimethylaminomethyl)benzoate Openeye Name: (2-sulfamoyl-1,3-benzothiazol-6-yl) 4-(dimethylaminomethyl)benzoate CAS Name: 4-(dimethylaminomethyl)benzoic acid (2-sulfamoyl-1,3-benzothiazol-6-yl) ester IUPAC Name: (2-sulfamoyl-1,3-benzothiazol-6-yl) 4-(dimethylaminomethyl)benzoate Traditional Name: 4-(dimethylaminomethyl)benzoic acid (2-sulfamoyl-1,3-benzothiazol-6-yl) ester Formula: C17H17N3O4S2 MolecularWeight: 391.46458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)N=C(S3)S(=O)(=O)N

Isomeric SMILES

CN(C)CC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)N=C(S3)S(=O)(=O)N

InChI

InChI=1S/C17H17N3O4S2/c1-20(2)10-11-3-5-12(6-4-11)16(21)24-13-7-8-14-15(9-13)25-17(19-14)26(18,22)23/h3-9H,10H2,1-2H3,(H2,18,22,23)