ESD
Summary
| Name: | (2-AMINO-ETHYLSULFANYL)-ACETIC ACID |
| Formula: | C4 H9 N O2 S |
| Formal charge: | 0 |
| Formula weight: | 135.185 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | [(2-aminoethyl)sulfanyl]acetic acid |
| OpenEye OEToolkits | 1.5.0 | 2-(2-aminoethylsulfanyl)ethanoic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)CSCCN |
| SMILES_CANONICAL | CACTVS | 3.341 | NCCSCC(O)=O |
| SMILES | CACTVS | 3.341 | NCCSCC(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(CSCC(=O)O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(CSCC(=O)O)N |
| InChI | InChI | 1.03 | InChI=1S/C4H9NO2S/c5-1-2-8-3-4(6)7/h1-3,5H2,(H,6,7) |
| InChIKey | InChI | 1.03 | HMZKKJDOCRYTTH-UHFFFAOYSA-N |
