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 Cc1cc(-c2ccc(NS(=O)(=O)c3ccccc3)c(C)c2)ccc1NS(=O)(=O)c1ccccc1

InChI

InChI=1S/C26H24N2O4S2/c1-19-17-21(13-15-25(19)27-33(29,30)23-9-5-3-6-10-23)22-14-16-26(20(2)18-22)28-34(31,32)24-11-7-4-8-12-24/h3-18,27-28H,1-2H3

InChIKey JDIKGJXBVUJVIH-UHFFFAOYSA-N

Molecular Weight

492.62