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
O=C1CCC(N2Cc3c(SCc4ccc(F)cc4)cccc3C2=O)C(=O)N1
InChI=1S/C20H17FN2O3S/c21-13-6-4-12(5-7-13)11-27-17-3-1-2-14-15(17)10-23(20(14)26)16-8-9-18(24)22-19(16)25/h1-7,16H,8-11H2,(H,22,24,25)
RMMTYLMFBUCYHO-UHFFFAOYSA-N
384.43