N2C
Summary
| Name: | N,S-DIMETHYLCYSTEINE |
| Formula: | C5 H11 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 149.211 Da |
| Component type: | L-PEPTIDE LINKING |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N,S-dimethyl-L-cysteine |
| OpenEye OEToolkits | 1.5.0 | (2R)-2-methylamino-3-methylsulfanyl-propanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)C(NC)CSC |
| SMILES_CANONICAL | CACTVS | 3.341 | CN[C@@H](CSC)C(O)=O |
| SMILES | CACTVS | 3.341 | CN[CH](CSC)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN[C@@H](CSC)C(=O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | CNC(CSC)C(=O)O |
| InChI | InChI | 1.03 | InChI=1S/C5H11NO2S/c1-6-4(3-9-2)5(7)8/h4,6H,3H2,1-2H3,(H,7,8)/t4-/m0/s1 |
| InChIKey | InChI | 1.03 | WQSNCKZPJSHACB-BYPYZUCNSA-N |
