1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-2-(4-chloranyl-2-methyl-phenoxy)ethanone

Systemtic Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-2-(4-chloranyl-2-methyl-phenoxy)ethanone Openeye Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-2-(4-chloro-2-methyl-phenoxy)ethanone CAS Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-2-(4-chloro-2-methylphenoxy)ethanone IUPAC Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-2-(4-chloro-2-methylphenoxy)ethanone Traditional Name: 2-(4-chloro-2-methyl-phenoxy)-1-(4-piazthiol-4-ylsulfonylpiperazino)ethanone Formula: C19H19ClN4O4S2 MolecularWeight: 466.96156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C19H19ClN4O4S2/c1-13-11-14(20)5-6-16(13)28-12-18(25)23-7-9-24(10-8-23)30(26,27)17-4-2-3-15-19(17)22-29-21-15/h2-6,11H,7-10,12H2,1H3