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
N#CCNC(=O)c1ccc(-c2ccnc(Nc3ccc(N4CCC(n5cncn5)CC4)cc3)n2)cc1
InChI=1S/C26H25N9O/c27-12-14-29-25(36)20-3-1-19(2-4-20)24-9-13-30-26(33-24)32-21-5-7-22(8-6-21)34-15-10-23(11-16-34)35-18-28-17-31-35/h1-9,13,17-18,23H,10-11,14-16H2,(H,29,36)(H,30,32,33)
CHYGCIUZUYLHGP-UHFFFAOYSA-N
479.55