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Murcko scaffold

Ring system with 4 rings and 26 atoms

5 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
26
Chemicals
5
With full pages
3
Scaffold SMILES

c1ccc(CSc2nnc(-c3ccccc3)c(-c3ccccc3)n2)cc1

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffold
Murcko scaffold c1ccc(CSc2nnc(-c3ccccc3)c(-c3ccccc3)n2)cc1

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 1 to 5 of 5 chemicals

2-{[(5,6-Diphenyl-1,2,4-triazin-3-yl)sulfanyl]methyl}benzonitrile chemical structure, C23H16N4S, CAS 332109-88-3
2-{[(5,6-Diphenyl-1,2,4-triazin-3-yl)sulfanyl]methyl}benzonitrile
CAS 332109-88-3C23H16N4S
3-((4-Nitrobenzyl)thio)-5,6-diphenyl-1,2,4-triazine chemical structure, C22H16N4O2S, CAS 332109-90-7
3-((4-Nitrobenzyl)thio)-5,6-diphenyl-1,2,4-triazine
CAS 332109-90-7C22H16N4O2S
4-Chlorobenzyl 5,6-diphenyl-1,2,4-triazin-3-yl sulfide chemical structure, C22H16ClN3S, CAS 330551-81-0
4-Chlorobenzyl 5,6-diphenyl-1,2,4-triazin-3-yl sulfide
CAS 330551-81-0C22H16ClN3S
3-((4-Bromobenzyl)thio)-5,6-diphenyl-1,2,4-triazine chemical structure, C22H16BrN3S, CAS 332110-05-1
3-((4-Bromobenzyl)thio)-5,6-diphenyl-1,2,4-triazine
CAS 332110-05-1C22H16BrN3S
3-[(3,4-Dichlorobenzyl)sulfanyl]-5,6-diphenyl-1,2,4-triazine chemical structure, C22H15Cl2N3S, CAS 452287-94-4
3-[(3,4-Dichlorobenzyl)sulfanyl]-5,6-diphenyl-1,2,4-triazine
CAS 452287-94-4C22H15Cl2N3S