0AJ
Summary
| Name: | (1R)-1-(ethylsulfanyl)-1-(methylsulfanyl)ethane |
| Formula: | C5 H12 S2 |
| Formal charge: | 0 |
| Formula weight: | 136.279 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (1R)-1-(ethylsulfanyl)-1-(methylsulfanyl)ethane |
| OpenEye OEToolkits | 1.5.0 | (1R)-1-ethylsulfanyl-1-methylsulfanyl-ethane |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | S(C)C(SCC)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CCS[C@H](C)SC |
| SMILES | CACTVS | 3.341 | CCS[CH](C)SC |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCS[C@H](C)SC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCSC(C)SC |
| InChI | InChI | 1.03 | InChI=1S/C5H12S2/c1-4-7-5(2)6-3/h5H,4H2,1-3H3/t5-/m1/s1 |
| InChIKey | InChI | 1.03 | RLVVEDPRNSYGPR-RXMQYKEDSA-N |
