Draw the molecule. Athanor plans the route.

A free chemistry editor that opens your ChemDraw files, predicts products as you draw and plans syntheses back to starting materials you can buy.

Windows 10 and 11 Updates itself from the Store

Open in browser

Runs in your browser. No account needed to draw.

Try
The structure of Caffeine

Caffeine

Systematic name (PubChem)
1,3,7-trimethylpurine-2,6-dione
Formula
C8H10N4O2
Molar mass
194.19 g/mol
Also known as
  • 1-methyltheobromine
  • 7-methyltheophylline
  • theine
  • guaranine

Data from PubChem, CID 2519. Other names from Athanor’s names index: ChEBI (release 257, CC BY 4.0), Wikidata (CC0).

A quick look only. Drawing, export, mechanisms, 3D, routes and everything else are in the full editor.

What you type here is sent to PubChem to look it up, and the structure to Athanor’s names index for its other names. Nothing is saved.

Retrosynthesis as you draw

Draw a target and an arrow pointing back. Athanor searches for routes while you watch, ranks them by steps and by what you can buy, and lists the hazards for every compound on the way.

What it does for your research

Paracetamol in Athanor with the Compound info panel: identified, CAS 103-90-2, and its systematic name N-(4-hydroxyphenyl)acetamide

It knows what you drew

Draw a structure and Athanor identifies it: its name, CAS number and PubChem record, and a systematic name worked out from the drawing itself. Every value says where it came from, and a missing one stays missing rather than being guessed.

Benzene in Athanor’s 3D view with its p orbitals in two phase colors

3D and orbitals from the same drawing

Lewis structures, orbitals and a rotatable 3D model come from the structure you already drew, with nothing to redraw. Export the view as an image.

Names and stereo you can check

Turn on stereochemistry and Athanor labels every stereocenter R or S and every double bond E or Z by the full CIP rules, updating as you draw. Athanor names structures with its own rules, and checks a name against OPSIN, the open-source name parser, in one click.

Search your documents by structure

Find every document, on your device or in your account, that contains a given molecule.

Switching from ChemDraw

Bring your files and keep your journal’s styles. Your shortcuts carry over

CDX and CDXML, both ways

Open your ChemDraw files as they are and save back to CDX or CDXML, so a collaborator on ChemDraw never has to know.

Journal document styles

21 presets, including ACS Document 1996, RSC one and two column, Wiley and Nature Research, so figures come out the size the journal asks for.

Copy into Word and PowerPointComing soon

Paste a structure into Word or PowerPoint as a sharp vector picture, with its chemistry carried along.

Plans and pricing

Every plan has the whole editor, ChemDraw files, mechanisms, 3D, problem sets with grading, collaboration and commercial use. Product prediction and routes need only a free account and never use credits.

The paid plans are one arbastro Suite subscription for every arbastro app.

Free

Students and anyone starting out

$0

AI credits a month
150
Assistant models
Haiku and Sonnet 5.5
Your own AI provider key
–
Cloud storage
10 MB

arbastro Suite Lite

For learning and teaching

$4.99

$4.17/mo

billed $49.99 yearly · save $9.89

Start 7-day free trial

Then $4.17/mo billed yearly ($49.99), or $4.99 monthly. Cancel any time before the trial ends.

AI credits a month
300
Assistant models
Haiku, Sonnet and Opus 5.5
Your own AI provider key
Cloud storage
100 MB
Most popular

arbastro Suite Plus

Best for active research

$19.99

$16.67/mo

billed $199.99 yearly · save $39.89

AI credits a month
1,000
Assistant models
Haiku, Sonnet and Opus 5.5, Fable 5.2
Your own AI provider key
Cloud storage
500 MB

arbastro Suite Ultra

For schools, labs and companies

$99.99

$83.33/mo

billed $999.99 yearly · save $199.89

AI credits a month
2,500
Assistant models
Haiku, Sonnet and Opus 5.5, Fable 5.2
Your own AI provider key
Cloud storage
3 GB

How Athanor compares

Swipe the table to see every tool

Athanor compared with ChemDraw, ChemDoodle, Marvin, Octet Draw, ChemSketch
AthanorChemDrawChemDoodleMarvinOctet DrawDiscontinued Aug 2026ChemSketch
Price & access
PriceFreePrime $700/yrProfessional $1,355/yr$199/yror $999 lifetime$29/mo academic$99/mo commercialFreeNo longer sold
Free for commercial work––––
Full editor in the browserEnterprise planDeveloper toolkit––
Prediction
Products predicted as you draw–From arrow pushing–––
Retrosynthesis route planning–Manual disconnections–––
Property predictionBasic
AI assistant that draws and animates–––––
Teaching
Problem sets with automatic grading21 question types–––––
Mechanism checking–––––
Moodle XML and QTI export–––––
Drawing & visualization
2D structure drawing
3D models–
Orbitals and MO diagramsOrbital palette–––
Animated mechanisms–––––
Biopolymers (HELM, peptides, DNA)––––
Data & workflow
Compound library with cited safety dataPubChem add‑in––––
Live collaborationIn testingEnterprise plan––––
Opens ChemDraw files
Name to structure for any IUPAC nameOnlineOffline–
Platforms
Desktop appWindowsWindows, MacWindows, Mac, LinuxWindows, Mac, LinuxWindows
Mac and LinuxIn the browserMac–
Works offlineDesktop appDesktop
Open source––––Apache‑2.0–
Where others do more
¹H and ¹³C NMR predictionPredicted, AI–
Fully offline, no account––
Office and ELN integration–LabArchivesOffice, on Mac–

Prices as of October 2026, from each vendor’s own page. Check with the vendor before you buy.

Athanor in your AI assistant

Claude, ChatGPT, Cursor and other assistants can use Athanor’s own chemistry engine through MCP: convert, name, draw and check structures, and run the safety screen. Free, with no account, and nothing stored.

The server

https://mcp-athanor.arbastro.com/mcp
  • convert SMILES, MOL and XYZ
  • name IUPAC and common names
  • properties formula, masses, descriptors
  • depict journal-style drawings
  • check valence, charge, stereo
  • screen the safety screen
  • library_search Athanor’s library

In Claude Code, one line

claude mcp add --transport http athanor https://mcp-athanor.arbastro.com/mcp

A real call: name on ibuprofen’s SMILES

Asking the server…
  • Local first, synced to your account

  • Screened for misuse

  • An open file format

FAQ

The Athanor app with an animated mechanism open on the canvas

Get Athanor

Free on Windows and in your browser.

  • Windows app

    Windows 10 and 11. Works offline after you sign in.

    Updates itself from the Store. The installer is under the arrow.

  • In your browser

    Chrome, Edge, Firefox or Safari.

    Open in browser

    Nothing to install.