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Summary
| Name: | (2-hydroxyphenyl)(pyrrolidin-1-yl)methanethione |
| Formula: | C11 H13 N O S |
| Formal charge: | 0 |
| Formula weight: | 207.292 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2-hydroxyphenyl)(pyrrolidin-1-yl)methanethione |
| OpenEye OEToolkits | 1.7.6 | (2-hydroxyphenyl)-pyrrolidin-1-yl-methanethione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | S=C(c1c(O)cccc1)N2CCCC2 |
| InChI | InChI | 1.03 | InChI=1S/C11H13NOS/c13-10-6-2-1-5-9(10)11(14)12-7-3-4-8-12/h1-2,5-6,13H,3-4,7-8H2 |
| InChIKey | InChI | 1.03 | QIKLOVZAPGSYNO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | Oc1ccccc1C(=S)N2CCCC2 |
| SMILES | CACTVS | 3.370 | Oc1ccccc1C(=S)N2CCCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc(c(c1)C(=S)N2CCCC2)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc(c(c1)C(=S)N2CCCC2)O |
