EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H15N5O4S |
| Net Charge | 0 |
| Average Mass | 337.361 |
| Monoisotopic Mass | 337.08447 |
| SMILES | CNC(=O)CSc1nnc(COc2ccc([N+](=O)[O-])cc2)n1C |
| InChI | InChI=1S/C13H15N5O4S/c1-14-12(19)8-23-13-16-15-11(17(13)2)7-22-10-5-3-9(4-6-10)18(20)21/h3-6H,7-8H2,1-2H3,(H,14,19) |
| InChIKey | FIHFVZJDXRIOLX-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-methyl-2-[[4-methyl-5-[(4-nitrophenoxy)methyl]-1,2,4-triazol-3-yl]thio]acetamide (CHEBI:107929) is a C-nitro compound (CHEBI:35716) |
| N-methyl-2-[[4-methyl-5-[(4-nitrophenoxy)methyl]-1,2,4-triazol-3-yl]thio]acetamide (CHEBI:107929) is a aromatic ether (CHEBI:35618) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19306 | LINCS |