3-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenyl]sulfonylthiolane 1,1-dioxide

Systemtic Name: 3-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenyl]sulfonylthiolane 1,1-dioxide Openeye Name: 3-[3-[4-(2-pyridyl)piperazin-1-yl]sulfonylphenyl]sulfonylthiolane 1,1-dioxide CAS Name: 3-[3-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]phenyl]sulfonylthiolane 1,1-dioxide IUPAC Name: 3-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylphenyl]sulfonylthiolane 1,1-dioxide Traditional Name: 3-[3-[4-(2-pyridyl)piperazino]sulfonylphenyl]sulfonylsulfolane Formula: C19H23N3O6S3 MolecularWeight: 485.59742

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C1CS(=O)(=O)CC1S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C19H23N3O6S3/c23-29(24)13-7-18(15-29)30(25,26)16-4-3-5-17(14-16)31(27,28)22-11-9-21(10-12-22)19-6-1-2-8-20-19/h1-6,8,14,18H,7,9-13,15H2