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
Cc1nc(C(=O)N2CC[C@H](C)[C@H]2c2nc3cc(C)c(C)cc3[nH]2)c(-c2cccc(Cl)c2)s1
InChI=1S/C25H25ClN4OS/c1-13-8-9-30(22(13)24-28-19-10-14(2)15(3)11-20(19)29-24)25(31)21-23(32-16(4)27-21)17-6-5-7-18(26)12-17/h5-7,10-13,22H,8-9H2,1-4H3,(H,28,29)/t13-,22-/m0/s1
BHYJNXZXWCRENL-XMHCIUCPSA-N
465.02