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Murcko scaffold

Ring system with 3 rings and 18 atoms

16 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
16
With full pages
0
Scaffold SMILES

O=c1cnn2cnnc2n1N=Cc1ccccc1

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=c1cnn2cnnc2n1N=Cc1ccccc1

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

(E)-6-(tert-Butyl)-8-((4-fluorobenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C15H15FN6O, CAS 328020-80-0
(E)-6-(tert-Butyl)-8-((4-fluorobenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 328020-80-0C15H15FN6O
(E)-6-(tert-Butyl)-8-((4-methylbenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C16H18N6O, CAS 328020-85-5
(E)-6-(tert-Butyl)-8-((4-methylbenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 328020-85-5C16H18N6O
(E)-6-(tert-Butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C17H21N7O, CAS 328020-84-4
(E)-6-(tert-Butyl)-8-((4-(dimethylamino)benzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 328020-84-4C17H21N7O
6-tert-Butyl-8-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C17H20N6O3, CAS 538338-19-1
6-tert-Butyl-8-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 538338-19-1C17H20N6O3
(E)-6-(tert-Butyl)-8-((2,4-dichlorobenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C15H14Cl2N6O, CAS 539805-73-7
(E)-6-(tert-Butyl)-8-((2,4-dichlorobenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 539805-73-7C15H14Cl2N6O
(E)-6-(tert-Butyl)-8-((4-chlorobenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C15H15ClN6O, CAS 538338-11-3
(E)-6-(tert-Butyl)-8-((4-chlorobenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 538338-11-3C15H15ClN6O
Methyl 4-{(E)-[(6-tert-butyl-7-oxo[1,2,4]triazolo[4,3-b][1,2,4]triazin-8(7H)-yl)imino]methyl}benzoate chemical structure, C17H18N6O3, CAS 539805-71-5
Methyl 4-{(E)-[(6-tert-butyl-7-oxo[1,2,4]triazolo[4,3-b][1,2,4]triazin-8(7H)-yl)imino]methyl}benzoate
CAS 539805-71-5C17H18N6O3
(E)-6-(tert-Butyl)-8-((3-nitrobenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C15H15N7O3, CAS 538338-21-5
(E)-6-(tert-Butyl)-8-((3-nitrobenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 538338-21-5C15H15N7O3
(E)-6-(tert-Butyl)-8-((2-nitrobenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C15H15N7O3, CAS 328020-79-7
(E)-6-(tert-Butyl)-8-((2-nitrobenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 328020-79-7C15H15N7O3
(E)-8-(Benzylideneamino)-6-(tert-butyl)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C15H16N6O, CAS 328020-96-8
(E)-8-(Benzylideneamino)-6-(tert-butyl)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 328020-96-8C15H16N6O
6-tert-Butyl-8-[(E)-[(2-iodophenyl)methylidene]amino]-7H,8H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-one chemical structure, C15H15IN6O, CAS 537702-93-5
6-tert-Butyl-8-[(E)-[(2-iodophenyl)methylidene]amino]-7H,8H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7-one
CAS 537702-93-5C15H15IN6O
6-tert-Butyl-8-{[(E)-(4-hydroxyphenyl)methylidene]amino}[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C15H16N6O2, CAS 328020-86-6
6-tert-Butyl-8-{[(E)-(4-hydroxyphenyl)methylidene]amino}[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 328020-86-6C15H16N6O2
(E)-6-(tert-Butyl)-8-((4-hydroxy-3-methoxybenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C16H18N6O3, CAS 538338-14-6
(E)-6-(tert-Butyl)-8-((4-hydroxy-3-methoxybenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 538338-14-6C16H18N6O3
(E)-6-(tert-Butyl)-8-((2-hydroxybenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C15H16N6O2, CAS 328020-82-2
(E)-6-(tert-Butyl)-8-((2-hydroxybenzylidene)amino)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 328020-82-2C15H16N6O2
6-tert-Butyl-8-{[(E)-(3-ethoxy-4-hydroxyphenyl)methylidene]amino}[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C17H20N6O3, CAS 328020-78-6
6-tert-Butyl-8-{[(E)-(3-ethoxy-4-hydroxyphenyl)methylidene]amino}[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 328020-78-6C17H20N6O3
(E)-8-((5-Bromo-2-hydroxybenzylidene)amino)-6-(tert-butyl)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one chemical structure, C15H15BrN6O2, CAS 539813-02-0
(E)-8-((5-Bromo-2-hydroxybenzylidene)amino)-6-(tert-butyl)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-7(8H)-one
CAS 539813-02-0C15H15BrN6O2