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
CC(SC[C@@H]1CCCN2CCCC[C@H]12)C(=O)N1c2ccccc2Sc2ccccc21
InChI=1S/C25H30N2OS2/c1-18(29-17-19-9-8-16-26-15-7-6-10-20(19)26)25(28)27-21-11-2-4-13-23(21)30-24-14-5-3-12-22(24)27/h2-5,11-14,18-20H,6-10,15-17H2,1H3/t18?,19-,20+/m0/s1
OIHWNHNKECXCTR-NRRUETGQSA-N
438.66