DA9
Summary
Name: | 2-azido-N-(2-sulfanylethyl)ethanamide |
Formula: | C4 H8 N4 O S |
Formal charge: | 0 |
Formula weight: | 160.198 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 1.6.1 | 2-azido-N-(2-sulfanylethyl)ethanamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES_CANONICAL | CACTVS | 3.352 | SCCNC(=O)CN=[N+]=[N-] |
SMILES | CACTVS | 3.352 | SCCNC(=O)CN=[N+]=[N-] |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C(CS)NC(=O)CN=[N+]=[N-] |
SMILES | OpenEye OEToolkits | 1.7.0 | C(CS)NC(=O)CN=[N+]=[N-] |
InChI | InChI | 1.03 | InChI=1S/C4H8N4OS/c5-8-7-3-4(9)6-1-2-10/h10H,1-3H2,(H,6,9) |
InChIKey | InChI | 1.03 | JSHBGIMPVAGZMY-UHFFFAOYSA-N |