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Murcko scaffold

Ring system with 4 rings and 27 atoms

15 chemicals on CompoundList share this ring system.

Rings: 4
Scaffold atoms: 27
Chemicals: 15
With full pages: 3

Scaffold SMILES

O=C1C(N=Nc2cccc(Nc3ncncn3)c2)C=NN1c1ccccc1

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=C1C(N=Nc2cccc(Nc3ncncn3)c2)C=NN1c1ccccc1

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 15 of 15 chemicals

Disodium 2,5-dichloro-4-[4-[[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulphonatophenyl]azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulphonate chemical structure, C19H10Cl4N8Na2O7S2, CAS 5089-16-7

Disodium 2,5-dichloro-4-[4-[[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulphonatophenyl]azo]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulphonate

CAS 5089-16-7C₁₉H₁₀Cl₄N₈Na₂O₇S₂

2,5-Dichloro-4-[4-[[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-3-methyl-5-oxo-4H-pyrazol-1-yl]benzenesulfonic acid chemical structure, C19H12Cl4N8O7S2, CAS 25489-31-0

2,5-Dichloro-4-[4-[[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-3-methyl-5-oxo-4H-pyrazol-1-yl]benzenesulfonic acid

CAS 25489-31-0C₁₉H₁₂Cl₄N₈O₇S₂

1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-, sodium salt (1:2) chemical structure, C19H10Cl2N8Na2O9S2, CAS 14552-81-9

1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-, sodium salt (1:2)

CAS 14552-81-9C₁₉H₁₀Cl₂N₈Na₂O₉S₂

4-(2-(5-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)-2-sulfophenyl)diazenyl)-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-1H-pyrazole-3-carboxylic acid chemical structure, C19H12Cl2N8O9S2, CAS 85946-19-6

4-(2-(5-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)-2-sulfophenyl)diazenyl)-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-1H-pyrazole-3-carboxylic acid

CAS 85946-19-6C₁₉H₁₂Cl₂N₈O₉S₂

1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-, sodium salt (1:3) chemical structure, C19H9Cl2N8Na3O9S2, CAS 70900-45-7

1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-, sodium salt (1:3)

CAS 70900-45-7C₁₉H₉Cl₂N₈Na₃O₉S₂

RefChem:117811 chemical structure, C23H19Cl3N8Na2O9S2, CAS 72214-19-8

CAS 72214-19-8C₂₃H₁₉Cl₃N₈Na₂O₉S₂

4-((4-Amino-6-chloro-1,3,5-triazin-2-yl)amino)-2-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulphophenyl)-1H-pyrazol-4-yl)azo)benzenesulphonic acid chemical structure, C19H16ClN9O7S2, CAS 84100-04-9

4-((4-Amino-6-chloro-1,3,5-triazin-2-yl)amino)-2-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulphophenyl)-1H-pyrazol-4-yl)azo)benzenesulphonic acid

CAS 84100-04-9C₁₉H₁₆ClN₉O₇S₂

Disodium 4-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)-2-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl)azo)benzenesulphonate chemical structure, C19H14ClN9Na2O7S2, CAS 84100-05-0

Disodium 4-((4-amino-6-chloro-1,3,5-triazin-2-yl)amino)-2-((4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl)azo)benzenesulphonate

CAS 84100-05-0C₁₉H₁₄ClN₉Na₂O₇S₂

4-((4-Chloro-6-isopropoxy-1,3,5-triazin-2-yl)amino)-2-((1-(2-chloro-6-methylphenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)benzenesulphonic acid chemical structure, C23H22Cl2N8O5S, CAS 93804-38-7

4-((4-Chloro-6-isopropoxy-1,3,5-triazin-2-yl)amino)-2-((1-(2-chloro-6-methylphenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)benzenesulphonic acid

CAS 93804-38-7C₂₃H₂₂Cl₂N₈O₅S

Sodium 2-[[1-(2-chloro-6-methylphenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]-4-[(4-chloro-6-propan-2-yloxy-1,3,5-triazin-2-yl)amino]benzenesulfonate chemical structure, C23H21Cl2N8NaO5S, CAS 89923-50-2

Sodium 2-[[1-(2-chloro-6-methylphenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]-4-[(4-chloro-6-propan-2-yloxy-1,3,5-triazin-2-yl)amino]benzenesulfonate

CAS 89923-50-2C₂₃H₂₁Cl₂N₈NaO₅S

4-((5-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)-2-sulphophenyl)azo)-4,5-dihydro-1-(2-methyl-4-sulphophenyl)-5-oxo-1H-pyrazole-3-carboxylic acid, sodium salt chemical structure, C20H11Cl2N8Na3O9S2, CAS 85959-12-2

4-((5-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)-2-sulphophenyl)azo)-4,5-dihydro-1-(2-methyl-4-sulphophenyl)-5-oxo-1H-pyrazole-3-carboxylic acid, sodium salt

CAS 85959-12-2C₂₀H₁₁Cl₂N₈Na₃O₉S₂

4-((5-((4-Amino-6-chloro-1,3,5-triazin-2-yl)amino)-2-sulphophenyl)azo)-1-(2-chlorophenyl)-4,5-dihydro-5-oxo-1H-pyrazole-3-carboxylicacid, sodium salt chemical structure, C19H11Cl2N9Na2O6S, CAS 99670-22-1

4-((5-((4-Amino-6-chloro-1,3,5-triazin-2-yl)amino)-2-sulphophenyl)azo)-1-(2-chlorophenyl)-4,5-dihydro-5-oxo-1H-pyrazole-3-carboxylicacid, sodium salt

CAS 99670-22-1C₁₉H₁₁Cl₂N₉Na₂O₆S

Sodium 4-((4-chloro-6-isopropoxy-1,3,5-triazin-2-yl)amino)-2-((1-(2-chloro-6-methylphenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)benzenesulphonate chemical structure, C23H21Cl2N8NaO5S

Sodium 4-((4-chloro-6-isopropoxy-1,3,5-triazin-2-yl)amino)-2-((1-(2-chloro-6-methylphenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)benzenesulphonate

C₂₃H₂₁Cl₂N₈NaO₅S

4-((5-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)-2-sulphophenyl)azo)-4,5-dihydro-5-oxo-1-(4-sulphophenyl)-1H-pyrazole-3-carboxylic acid, potassium sodium salt chemical structure, C19H12Cl2KN8NaO9S2+2, CAS 85631-78-3

4-((5-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)-2-sulphophenyl)azo)-4,5-dihydro-5-oxo-1-(4-sulphophenyl)-1H-pyrazole-3-carboxylic acid, potassium sodium salt

CAS 85631-78-3C₁₉H₁₂Cl₂KN₈NaO₉S₂+₂

1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[[4,6-bis[(3-sulfopropyl)thio]-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]diazenyl]-1-(2,5-dichloro-4-sulfophenyl)-4,5-dihydro-5-oxo-, sodium salt (1:5) chemical structure, C25H19Cl2N8Na5O15S6, CAS 187674-76-6

1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[[4,6-bis[(3-sulfopropyl)thio]-1,3,5-triazin-2-yl]amino]-2-sulfophenyl]diazenyl]-1-(2,5-dichloro-4-sulfophenyl)-4,5-dihydro-5-oxo-, sodium salt (1:5)

CAS 187674-76-6C₂₅H₁₉Cl₂N₈Na₅O₁₅S₆