2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-methylsulfonylphenyl)ethanamide Openeye Name: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-methylsulfonylphenyl)acetamide CAS Name: 2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-N-(3-methylsulfonylphenyl)acetamide IUPAC Name: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(3-methylsulfonylphenyl)acetamide Traditional Name: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazino]-N-(3-mesylphenyl)acetamide Formula: C21H27N3O5S2 MolecularWeight: 465.58618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)C)C

InChI

InChI=1S/C21H27N3O5S2/c1-16-7-8-20(17(2)13-16)31(28,29)24-11-9-23(10-12-24)15-21(25)22-18-5-4-6-19(14-18)30(3,26)27/h4-8,13-14H,9-12,15H2,1-3H3,(H,22,25)