Identifier Cleaner
Convert between SMILES, InChI, InChIKey, and compound names. Supports PubChem name resolution as a fallback when the input is a common drug name.
Example: aspirin
→ CC(=O)Oc1ccccc1C(=O)O
C/C=C/C(=O)Nc1cccc(Oc2nc(Nc3ccc(OC)nc3)nc3ccsc23)c1
InChI=1S/C22H19N5O3S/c1-3-5-18(28)24-14-6-4-7-16(12-14)30-21-20-17(10-11-31-20)26-22(27-21)25-15-8-9-19(29-2)23-13-15/h3-13H,1-2H3,(H,24,28)(H,25,26,27)/b5-3+
SEHISGSDSAYWGY-HWKANZROSA-N
433.49