3-(4-chlorophenyl)sulfonyl-1-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(4-chlorophenyl)sulfonyl-1-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one Openeye Name: 3-(4-chlorophenyl)sulfonyl-1-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one CAS Name: 3-(4-chlorophenyl)sulfonyl-1-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-chlorophenyl)sulfonyl-1-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one Traditional Name: 3-(4-chlorophenyl)sulfonyl-1-[4-(6-mesyl-1,3-benzothiazol-2-yl)piperazino]propan-1-one Formula: C21H22ClN3O5S3 MolecularWeight: 528.06448

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C(=O)CCS(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C(=O)CCS(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O5S3/c1-32(27,28)17-6-7-18-19(14-17)31-21(23-18)25-11-9-24(10-12-25)20(26)8-13-33(29,30)16-4-2-15(22)3-5-16/h2-7,14H,8-13H2,1H3