3-(4-ethylpiperazin-1-yl)-4-(2-methoxy-5-methyl-phenyl)sulfonyl-thiolane 1,1-dioxide

Systemtic Name: 3-(4-ethylpiperazin-1-yl)-4-(2-methoxy-5-methyl-phenyl)sulfonyl-thiolane 1,1-dioxide Openeye Name: 3-(4-ethylpiperazin-1-yl)-4-(2-methoxy-5-methyl-phenyl)sulfonyl-thiolane 1,1-dioxide CAS Name: 3-(4-ethyl-1-piperazinyl)-4-(2-methoxy-5-methylphenyl)sulfonylthiolane 1,1-dioxide IUPAC Name: 3-(4-ethylpiperazin-1-yl)-4-(2-methoxy-5-methylphenyl)sulfonylthiolane 1,1-dioxide Traditional Name: 3-(4-ethylpiperazino)-4-(2-methoxy-5-methyl-phenyl)sulfonyl-sulfolane Formula: C18H28N2O5S2 MolecularWeight: 416.55532

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2CS(=O)(=O)CC2S(=O)(=O)C3=C(C=CC(=C3)C)OC

Isomeric SMILES

CCN1CCN(CC1)C2CS(=O)(=O)CC2S(=O)(=O)C3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C18H28N2O5S2/c1-4-19-7-9-20(10-8-19)15-12-26(21,22)13-18(15)27(23,24)17-11-14(2)5-6-16(17)25-3/h5-6,11,15,18H,4,7-10,12-13H2,1-3H3