2-(4-chlorophenyl)sulfonyl-1-[4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-chlorophenyl)sulfonyl-1-[4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-(4-chlorophenyl)sulfonyl-1-[4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone CAS Name: 2-(4-chlorophenyl)sulfonyl-1-[4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-chlorophenyl)sulfonyl-1-[4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-(4-chlorophenyl)sulfonyl-1-[4-(4,7-dimethoxy-1,3-benzothiazol-2-yl)piperazino]ethanone Formula: C21H22ClN3O5S2 MolecularWeight: 495.99948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=N2)N3CCN(CC3)C(=O)CS(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)SC(=N2)N3CCN(CC3)C(=O)CS(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O5S2/c1-29-16-7-8-17(30-2)20-19(16)23-21(31-20)25-11-9-24(10-12-25)18(26)13-32(27,28)15-5-3-14(22)4-6-15/h3-8H,9-13H2,1-2H3