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

Free Research Context Use this tool freely, then open the research home or demo workspace when you want project context.

Research home Demo workspace

Canonical SMILES CCN1CCC=C(c2nnn(CC)n2)C1

InChI InChI=1S/C10H17N5/c1-3-14-7-5-6-9(8-14)10-11-13-15(4-2)12-10/h6H,3-5,7-8H2,1-2H3

InChIKey RYUSRFZDDKHDHC-UHFFFAOYSA-N

Molecular Weight

207.28