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2-[3,5-dimethyl-4-[3-(methylsulfonylamino)phenyl]sulfonyl-piperazin-1-yl]-N-(2-methylphenyl)ethanamide
2-[3,5-dimethyl-4-[3-(methylsulfonylamino)phenyl]sulfonyl-piperazin-1-yl]-N-(2-methylphenyl)ethanamide
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Descriptors Computed from Structure
Canonical SMILES:
CC1CN(CC(N1S(=O)(=O)C2=CC=CC(=C2)NS(=O)(=O)C)C)CC(=O)NC3=CC=CC=C3C
Isomeric SMILES
CC1CN(CC(N1S(=O)(=O)C2=CC=CC(=C2)NS(=O)(=O)C)C)CC(=O)NC3=CC=CC=C3C
InChI
InChI=1S/C22H30N4O5S2/c1-16-8-5-6-11-21(16)23-22(27)15-25-13-17(2)26(18(3)14-25)33(30,31)20-10-7-9-19(12-20)24-32(4,28)29/h5-12,17-18,24H,13-15H2,1-4H3,(H,23,27)
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