EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H8IN2S |
| Net Charge | +1 |
| Average Mass | 303.148 |
| Monoisotopic Mass | 302.94474 |
| SMILES | [H]c1c([H])c(I)c2c([H])c(C(N([H])[H])=[N+]([H])[H])sc2c1[H] |
| InChI | InChI=1S/C9H7IN2S/c10-6-2-1-3-7-5(6)4-8(13-7)9(11)12/h1-4H,(H3,11,12)/p+1 |
| InChIKey | YERQOXAYAFWFEJ-UHFFFAOYSA-O |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE (CHEBI:42358) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| 4-IODOBENZO[B]THIOPHENE-2-CARBOXAMIDINE | PDBeChem |
| amino(4-iodo-1-benzothiophen-2-yl)methaniminium | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| ESI | PDBeChem |