6FR
1-[(2-cyclopentylethyl)sulfonyl]pyrrolidine
Created: | 2016-03-31 |
Last modified: | 2017-03-29 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 36 |
Chiral Atom Count | 0 |
Bond Count | 37 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | 1-[(2-cyclopentylethyl)sulfonyl]pyrrolidine |
Systematic Name (OpenEye OEToolkits) | 1-(2-cyclopentylethylsulfonyl)pyrrolidine |
Formula | C11 H21 N O2 S |
Molecular Weight | 231.355 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=S(CCC1CCCC1)(=O)N2CCCC2 |
SMILES | CACTVS | 3.385 | O=[S](=O)(CCC1CCCC1)N2CCCC2 |
SMILES | OpenEye OEToolkits | 2.0.4 | C1CCC(C1)CCS(=O)(=O)N2CCCC2 |
Canonical SMILES | CACTVS | 3.385 | O=[S](=O)(CCC1CCCC1)N2CCCC2 |
Canonical SMILES | OpenEye OEToolkits | 2.0.4 | C1CCC(C1)CCS(=O)(=O)N2CCCC2 |
InChI | InChI | 1.03 | InChI=1S/C11H21NO2S/c13-15(14,12-8-3-4-9-12)10-7-11-5-1-2-6-11/h11H,1-10H2 |
InChIKey | InChI | 1.03 | UAJGQMZYCCWBAX-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 124222729 |