3-[4-(3-chlorophenyl)piperazin-1-yl]-4-(4-ethylphenyl)sulfonyl-thiolane 1,1-dioxide

Systemtic Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-4-(4-ethylphenyl)sulfonyl-thiolane 1,1-dioxide Openeye Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-4-(4-ethylphenyl)sulfonyl-thiolane 1,1-dioxide CAS Name: 3-[4-(3-chlorophenyl)-1-piperazinyl]-4-(4-ethylphenyl)sulfonylthiolane 1,1-dioxide IUPAC Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-4-(4-ethylphenyl)sulfonylthiolane 1,1-dioxide Traditional Name: 3-[4-(3-chlorophenyl)piperazino]-4-(4-ethylphenyl)sulfonyl-sulfolane Formula: C22H27ClN2O4S2 MolecularWeight: 483.04378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClN2O4S2/c1-2-17-6-8-20(9-7-17)31(28,29)22-16-30(26,27)15-21(22)25-12-10-24(11-13-25)19-5-3-4-18(23)14-19/h3-9,14,21-22H,2,10-13,15-16H2,1H3