0VZ
ethyl (2Z,4R)-2-(sulfamoylimino)-1,3-thiazolidine-4-carboxylate
| Created: | 2012-07-15 | 
| Last modified: | 2013-07-03 | 
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| Chemical Details | |
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| Formal Charge | 0 | 
| Atom Count | 26 | 
| Chiral Atom Count | 1 | 
| Bond Count | 26 | 
| Aromatic Bond Count | 0 | 
| Chemical Component Summary | |
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| Name | ethyl (2Z,4R)-2-(sulfamoylimino)-1,3-thiazolidine-4-carboxylate | 
| Systematic Name (OpenEye OEToolkits) | ethyl (2Z,4R)-2-sulfamoylimino-1,3-thiazolidine-4-carboxylate | 
| Formula | C6 H11 N3 O4 S2 | 
| Molecular Weight | 253.299 | 
| Type | NON-POLYMER | 
| Chemical Descriptors | |||
|---|---|---|---|
| Type | Program | Version | Descriptor | 
| SMILES | ACDLabs | 12.01 | O=S(=O)(/N=C1\SCC(C(=O)OCC)N1)N | 
| SMILES | CACTVS | 3.370 | CCOC(=O)[CH]1CSC(N1)=N[S](N)(=O)=O | 
| SMILES | OpenEye OEToolkits | 1.7.6 | CCOC(=O)C1CSC(=NS(=O)(=O)N)N1 | 
| Canonical SMILES | CACTVS | 3.370 | CCOC(=O)[C@@H]1CSC(N1)=N[S](N)(=O)=O | 
| Canonical SMILES | OpenEye OEToolkits | 1.7.6 | CCOC(=O)[C@@H]1CS/C(=N\S(=O)(=O)N)/N1 | 
| InChI | InChI | 1.03 | InChI=1S/C6H11N3O4S2/c1-2-13-5(10)4-3-14-6(8-4)9-15(7,11)12/h4H,2-3H2,1H3,(H,8,9)(H2,7,11,12)/t4-/m0/s1 | 
| InChIKey | InChI | 1.03 | JQTAIDJUEICDHW-BYPYZUCNSA-N | 
Related Resource References
| Resource Name | Reference | 
|---|---|
| PubChem | 137347900 | 














