3-(4-ethylphenyl)sulfonyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)thiolane 1,1-dioxide

Systemtic Name: 3-(4-ethylphenyl)sulfonyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)thiolane 1,1-dioxide Openeye Name: 3-(4-ethylphenyl)sulfonyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)thiolane 1,1-dioxide CAS Name: 3-(4-ethylphenyl)sulfonyl-4-[4-(2-pyrimidinyl)-1-piperazinyl]thiolane 1,1-dioxide IUPAC Name: 3-(4-ethylphenyl)sulfonyl-4-(4-pyrimidin-2-ylpiperazin-1-yl)thiolane 1,1-dioxide Traditional Name: 3-(4-ethylphenyl)sulfonyl-4-[4-(2-pyrimidyl)piperazino]sulfolane Formula: C20H26N4O4S2 MolecularWeight: 450.57484

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)C2CS(=O)(=O)CC2N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)C2CS(=O)(=O)CC2N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H26N4O4S2/c1-2-16-4-6-17(7-5-16)30(27,28)19-15-29(25,26)14-18(19)23-10-12-24(13-11-23)20-21-8-3-9-22-20/h3-9,18-19H,2,10-15H2,1H3