EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:117154 - 3,4-dimethoxy-N-[(2-methyl-4-nitroanilino)-sulfanylidenemethyl]benzamide
| Formula | C17H17N3O5S |
| Net Charge | 0 |
| Average Mass | 375.406 |
| Monoisotopic Mass | 375.08889 |
| SMILES | COc1ccc(C(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2C)cc1OC |
| InChI | InChI=1S/C17H17N3O5S/c1-10-8-12(20(22)23)5-6-13(10)18-17(26)19-16(21)11-4-7-14(24-2)15(9-11)25-3/h4-9H,1-3H3,(H2,18,19,21,26) |
| InChIKey | XUSZBFUXDMYUOG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3,4-dimethoxy-N-[(2-methyl-4-nitroanilino)-sulfanylidenemethyl]benzamide (CHEBI:117154) is a thioureas (CHEBI:51276) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28603 | LINCS |