FST
Summary
| Name: | O,O-diethyl O-{4-[(R)-methylsulfinyl]phenyl} phosphorothioate |
| Synonyms: | Fensulfothion |
| Formula: | C11 H17 O4 P S2 |
| Formal charge: | 0 |
| Formula weight: | 308.354 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | O,O-diethyl O-{4-[(R)-methylsulfinyl]phenyl} phosphorothioate |
| OpenEye OEToolkits | 1.7.6 | diethoxy-[4-[(R)-methylsulfinyl]phenoxy]-sulfanylidene-$l^{5}-phosphane |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=S(c1ccc(OP(=S)(OCC)OCC)cc1)C |
| InChI | InChI | 1.03 | InChI=1S/C11H17O4PS2/c1-4-13-16(17,14-5-2)15-10-6-8-11(9-7-10)18(3)12/h6-9H,4-5H2,1-3H3/t18-/m1/s1 |
| InChIKey | InChI | 1.03 | XDNBJTQLKCIJBV-GOSISDBHSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CCO[P](=S)(OCC)Oc1ccc(cc1)[S@@](C)=O |
| SMILES | CACTVS | 3.370 | CCO[P](=S)(OCC)Oc1ccc(cc1)[S](C)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCOP(=S)(OCC)Oc1ccc(cc1)[S@](=O)C |
| SMILES | OpenEye OEToolkits | 1.7.6 | CCOP(=S)(OCC)Oc1ccc(cc1)S(=O)C |
