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Murcko scaffold

Ring system with 6 rings and 23 atoms

10 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
23
Chemicals
10
With full pages
4
Scaffold SMILES

O=C(NN1C(=O)C2C3C=CC(C4CC34)C2C1=O)c1ccccc1

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 O=C(NN1C(=O)C2C3C=CC(C4CC34)C2C1=O)c1ccccc1

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 10 of 10 chemicals

3-Bromo-N-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzamide chemical structure, C18H15BrN2O3, CAS 323203-24-3
3-Bromo-N-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzamide
CAS 323203-24-3C18H15BrN2O3
4-Chloro-N-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzamide chemical structure, C18H15ClN2O3, CAS 313270-75-6
4-Chloro-N-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)benzamide
CAS 313270-75-6C18H15ClN2O3
N-[(2R,6S,8S,10R)-3,5-Dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]-4-(trifluoromethyl)benzamide chemical structure, C19H15F3N2O3
N-[(2R,6S,8S,10R)-3,5-Dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]-4-(trifluoromethyl)benzamide
C19H15F3N2O3
Tecovirimat chemical structure, C19H15F3N2O3, CAS 869572-92-9
Tecovirimat
CAS 869572-92-9C19H15F3N2O3
Tecovirimat (ST-246) chemical structure, C19H15F3N2O3, CAS 816458-31-8
Tecovirimat (ST-246)
CAS 816458-31-8C19H15F3N2O3
Tecovirimat monohydrate chemical structure, C19H17F3N2O4, CAS 1162664-19-8
Tecovirimat monohydrate
CAS 1162664-19-8C19H17F3N2O4
N-((3aR,4S,4aR,5aS,6S,6aS)-1,3-dioxo-3,3a,4,4a,5,5a,6,6a-octahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)-4-(trifluoromethyl)benzamide chemical structure, C19H15F3N2O3
N-((3aR,4S,4aR,5aS,6S,6aS)-1,3-dioxo-3,3a,4,4a,5,5a,6,6a-octahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)-4-(trifluoromethyl)benzamide
C19H15F3N2O3
N-[(1R,2R,6S,7S,8R,10R)-3,5-Dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]-4-(trifluoromethyl)benzamide chemical structure, C19H15F3N2O3
N-[(1R,2R,6S,7S,8R,10R)-3,5-Dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]-4-(trifluoromethyl)benzamide
C19H15F3N2O3
Tecovirimat-D4 chemical structure, C19H15F3N2O3, CAS 2923753-84-6
Tecovirimat-D4
CAS 2923753-84-6C19H15F3N2O3
N-[(6S)-3,5-Dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]-4-(trifluoromethyl)benzamide chemical structure, C19H15F3N2O3
N-[(6S)-3,5-Dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]-4-(trifluoromethyl)benzamide
C19H15F3N2O3