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

Systemtic Name: [2-(4-methylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 4-[ethyl-(phenylmethyl)sulfamoyl]benzoate Openeye Name: [2-(4-methylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 4-[benzyl(ethyl)sulfamoyl]benzoate CAS Name: 4-[ethyl-(phenylmethyl)sulfamoyl]benzoic acid [2-(4-methyl-1-piperazinyl)-1,3-benzothiazol-6-yl] ester IUPAC Name: [2-(4-methylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 4-[benzyl(ethyl)sulfamoyl]benzoate Traditional Name: 4-[benzyl(ethyl)sulfamoyl]benzoic acid [2-(4-methylpiperazino)-1,3-benzothiazol-6-yl] ester Formula: C28H30N4O4S2 MolecularWeight: 550.6922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=CC4=C(C=C3)N=C(S4)N5CCN(CC5)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OC3=CC4=C(C=C3)N=C(S4)N5CCN(CC5)C

InChI

InChI=1S/C28H30N4O4S2/c1-3-32(20-21-7-5-4-6-8-21)38(34,35)24-12-9-22(10-13-24)27(33)36-23-11-14-25-26(19-23)37-28(29-25)31-17-15-30(2)16-18-31/h4-14,19H,3,15-18,20H2,1-2H3