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
COc1ccc(Cn2c(=O)n(C)c3c4cc(-c5ccc6nc(N)sc6c5)ccc4ncc32)cc1
InChI=1S/C26H21N5O2S/c1-30-24-19-11-16(17-6-10-21-23(12-17)34-25(27)29-21)5-9-20(19)28-13-22(24)31(26(30)32)14-15-3-7-18(33-2)8-4-15/h3-13H,14H2,1-2H3,(H2,27,29)
BBOCBKAFNJRALF-UHFFFAOYSA-N
467.55