1-[4-[(3S)-4-(4-ethanoylphenyl)sulfonyl-3-methyl-piperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[4-[(3S)-4-(4-ethanoylphenyl)sulfonyl-3-methyl-piperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[(3S)-4-(4-acetylphenyl)sulfonyl-3-methyl-piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[4-[[(3S)-4-(4-acetylphenyl)sulfonyl-3-methyl-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[(3S)-4-(4-acetylphenyl)sulfonyl-3-methylpiperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[(3S)-4-(4-acetylphenyl)sulfonyl-3-methyl-piperazino]sulfonylphenyl]ethanone Formula: C21H24N2O6S2 MolecularWeight: 464.55506

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)C)S(=O)(=O)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

C[C@H]1CN(CCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)C)S(=O)(=O)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H24N2O6S2/c1-15-14-22(30(26,27)20-8-4-18(5-9-20)16(2)24)12-13-23(15)31(28,29)21-10-6-19(7-11-21)17(3)25/h4-11,15H,12-14H2,1-3H3/t15-/m0/s1