9UT
Summary
Name: | 1,3-thiazole-2,4-dione |
Formula: | C3 H3 N O2 S |
Formal charge: | 0 |
Formula weight: | 117.126 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 1,3-thiazole-2,4-dione |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C3H3NO2S/c5-2-1-7-3(6)4-2/h1,7H,(H,4,5,6) |
InChIKey | InChI | 1.03 | OKCMWAHWBYXJPD-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O=C1NC(=O)[SH]=C1 |
SMILES | CACTVS | 3.385 | O=C1NC(=O)[SH]=C1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C1=SC(=O)NC1=O |
SMILES | OpenEye OEToolkits | 2.0.6 | C1=SC(=O)NC1=O |