EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:123441 - 2-[(4-chlorophenyl)thio]-1-methyl-3-indolecarboxaldehyde
| Formula | C16H12ClNOS |
| Net Charge | 0 |
| Average Mass | 301.798 |
| Monoisotopic Mass | 301.03281 |
| SMILES | Cn1c(Sc2ccc(Cl)cc2)c(C=O)c2ccccc21 |
| InChI | InChI=1S/C16H12ClNOS/c1-18-15-5-3-2-4-13(15)14(10-19)16(18)20-12-8-6-11(17)7-9-12/h2-10H,1H3 |
| InChIKey | YWJPKXRAUPCQFC-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[(4-chlorophenyl)thio]-1-methyl-3-indolecarboxaldehyde (CHEBI:123441) is a aryl sulfide (CHEBI:35683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-34883 | LINCS |