TZP
Summary
Name: | 4-METHYL-5-HYDROXYETHYLTHIAZOLE PHOSPHATE |
Formula: | C6 H10 N O4 P S |
Formal charge: | 0 |
Formula weight: | 223.187 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 2-(4-methyl-1,3-thiazol-5-yl)ethyl dihydrogen phosphate |
OpenEye OEToolkits | 1.5.0 | 2-(4-methyl-1,3-thiazol-5-yl)ethyl dihydrogen phosphate |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=P(OCCc1scnc1C)(O)O |
SMILES_CANONICAL | CACTVS | 3.341 | Cc1ncsc1CCO[P](O)(O)=O |
SMILES | CACTVS | 3.341 | Cc1ncsc1CCO[P](O)(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | Cc1c(scn1)CCOP(=O)(O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | Cc1c(scn1)CCOP(=O)(O)O |
InChI | InChI | 1.03 | InChI=1S/C6H10NO4PS/c1-5-6(13-4-7-5)2-3-11-12(8,9)10/h4H,2-3H2,1H3,(H2,8,9,10) |
InChIKey | InChI | 1.03 | OCYMERZCMYJQQO-UHFFFAOYSA-N |