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
Cc1ccc(-c2c(NS(=O)(=O)/C=C/c3ccccc3)ncnc2OCCOc2ncc(Br)cn2)cc1
InChI=1S/C25H22BrN5O4S/c1-18-7-9-20(10-8-18)22-23(31-36(32,33)14-11-19-5-3-2-4-6-19)29-17-30-24(22)34-12-13-35-25-27-15-21(26)16-28-25/h2-11,14-17H,12-13H2,1H3,(H,29,30,31)/b14-11+
RPBOIJRVAJKCSF-SDNWHVSQSA-N
568.45