EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H23N5O2S2 |
| Net Charge | 0 |
| Average Mass | 393.538 |
| Monoisotopic Mass | 393.12932 |
| SMILES | Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1csc(C(C)(C)C)n1 |
| InChI | InChI=1S/C17H23N5O2S2/c1-9-12(10-8-25-14(20-10)17(2,3)4)26-15(19-9)21-16(24)22-7-5-6-11(22)13(18)23/h8,11H,5-7H2,1-4H3,(H2,18,23)(H,19,21,24)/t11-/m0/s1 |
| InChIKey | HBPXWEPKNBHKAX-NSHDSACASA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2S)-N1-[5-(2-tert-butyl-4-thiazolyl)-4-methyl-2-thiazolyl]pyrrolidine-1,2-dicarboxamide (CHEBI:91449) is a proline derivative (CHEBI:26273) |
| Manual Xrefs | Databases |
|---|---|
| LSM-1204 | LINCS |