Murcko scaffold
Ring system with 5 rings and 28 atoms
16 chemicals on CompoundList share this ring system.
- Rings
- 5
- Scaffold atoms
- 28
- Chemicals
- 16
- With full pages
- 4
Scaffold SMILES
O=C1C(Nc2ccccc2)=C(n2nnc3ccccc32)C(=O)c2ccccc21
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.
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 16 of 16 chemicals
![3-[[3-(Benzotriazol-1-yl)-1,4-dioxonaphthalen-2-yl]amino]benzoic acid chemical structure, C23H14N4O4, CAS 384794-24-5](/s/SEXWJBVPCJURDW-UHFFFAOYSA-N.svg)
3-[[3-(Benzotriazol-1-yl)-1,4-dioxonaphthalen-2-yl]amino]benzoic acid
CAS 384794-24-5C23H14N4O4
![2-(1H-Benzotriazol-1-yl)-3-[(4-methoxyphenyl)amino]naphthalene-1,4-dione chemical structure, C23H16N4O3, CAS 370572-95-5](/s/PBHHQZFRBOZMHA-UHFFFAOYSA-N.svg)
2-(1H-Benzotriazol-1-yl)-3-[(4-methoxyphenyl)amino]naphthalene-1,4-dione
CAS 370572-95-5C23H16N4O3
![4-[[3-(Benzotriazol-1-yl)-1,4-dioxonaphthalen-2-yl]amino]benzoic acid chemical structure, C23H14N4O4, CAS 586986-62-1](/s/MXEWFUONLMVUJE-UHFFFAOYSA-N.svg)
4-[[3-(Benzotriazol-1-yl)-1,4-dioxonaphthalen-2-yl]amino]benzoic acid
CAS 586986-62-1C23H14N4O4
![2-((4-Acetylphenyl)amino)-3-(1H-benzo[d][1,2,3]triazol-1-yl)naphthalene-1,4-dione chemical structure, C24H16N4O3, CAS 714935-87-2](/s/QZGIGUHQMPGTNJ-UHFFFAOYSA-N.svg)
2-((4-Acetylphenyl)amino)-3-(1H-benzo[d][1,2,3]triazol-1-yl)naphthalene-1,4-dione
CAS 714935-87-2C24H16N4O3
![2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((3-(trifluoromethyl)phenyl)amino)naphthalene-1,4-dione chemical structure, C23H13F3N4O2, CAS 385387-33-7](/s/LXADAEFMDHKHSL-UHFFFAOYSA-N.svg)
2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((3-(trifluoromethyl)phenyl)amino)naphthalene-1,4-dione
CAS 385387-33-7C23H13F3N4O2
![2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((2-methoxyphenyl)amino)naphthalene-1,4-dione chemical structure, C23H16N4O3, CAS 371133-67-4](/s/BWDYHTFQAJCLLR-UHFFFAOYSA-N.svg)
2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((2-methoxyphenyl)amino)naphthalene-1,4-dione
CAS 371133-67-4C23H16N4O3
![2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((3-methoxyphenyl)amino)naphthalene-1,4-dione chemical structure, C23H16N4O3, CAS 371138-12-4](/s/GAHIGUAKGRTCFN-UHFFFAOYSA-N.svg)
2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((3-methoxyphenyl)amino)naphthalene-1,4-dione
CAS 371138-12-4C23H16N4O3
![2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((3-hydroxyphenyl)amino)naphthalene-1,4-dione chemical structure, C22H14N4O3, CAS 371211-58-4](/s/XLXLKFIBZURUOT-UHFFFAOYSA-N.svg)
2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((3-hydroxyphenyl)amino)naphthalene-1,4-dione
CAS 371211-58-4C22H14N4O3
![2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-(m-tolylamino)naphthalene-1,4-dione chemical structure, C23H16N4O2, CAS 371214-06-1](/s/ZCNKCSXMIQPRCU-UHFFFAOYSA-N.svg)
2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-(m-tolylamino)naphthalene-1,4-dione
CAS 371214-06-1C23H16N4O2
![2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-(p-tolylamino)naphthalene-1,4-dione chemical structure, C23H16N4O2, CAS 371231-46-8](/s/PTTPDVGSVDDBOJ-UHFFFAOYSA-N.svg)
2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-(p-tolylamino)naphthalene-1,4-dione
CAS 371231-46-8C23H16N4O2
![2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((4-bromophenyl)amino)naphthalene-1,4-dione chemical structure, C22H13BrN4O2, CAS 385394-68-3](/s/HQSSJTGCTIYXBK-UHFFFAOYSA-N.svg)
2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((4-bromophenyl)amino)naphthalene-1,4-dione
CAS 385394-68-3C22H13BrN4O2
![2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((4-(dimethylamino)phenyl)amino)naphthalene-1,4-dione chemical structure, C24H19N5O2, CAS 385420-26-8](/s/YTVLQVOUYKRXCS-UHFFFAOYSA-N.svg)
2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((4-(dimethylamino)phenyl)amino)naphthalene-1,4-dione
CAS 385420-26-8C24H19N5O2
![2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((4-(diethylamino)phenyl)amino)naphthalene-1,4-dione chemical structure, C26H23N5O2, CAS 489415-93-2](/s/DTKNTHVILHOGAN-UHFFFAOYSA-N.svg)
2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((4-(diethylamino)phenyl)amino)naphthalene-1,4-dione
CAS 489415-93-2C26H23N5O2
![2-((3-(1H-Benzo[d][1,2,3]triazol-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino)benzoic acid chemical structure, C23H14N4O4, CAS 850782-39-7](/s/JRIKZKUKMTWSSJ-UHFFFAOYSA-N.svg)
2-((3-(1H-Benzo[d][1,2,3]triazol-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino)benzoic acid
CAS 850782-39-7C23H14N4O4
![2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((3-bromophenyl)amino)naphthalene-1,4-dione chemical structure, C22H13BrN4O2, CAS 850782-40-0](/s/ZDWFGMROGLBECY-UHFFFAOYSA-N.svg)
2-(1H-Benzo[d][1,2,3]triazol-1-yl)-3-((3-bromophenyl)amino)naphthalene-1,4-dione
CAS 850782-40-0C22H13BrN4O2
![Ethyl 4-((3-(1H-benzo[d][1,2,3]triazol-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino)benzoate chemical structure, C25H18N4O4, CAS 850782-41-1](/s/RHMILIMCFBZKTF-UHFFFAOYSA-N.svg)
Ethyl 4-((3-(1H-benzo[d][1,2,3]triazol-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)amino)benzoate
CAS 850782-41-1C25H18N4O4