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Murcko scaffold

Ring system with 4 rings and 27 atoms

13 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
27
Chemicals
13
With full pages
1
Scaffold SMILES

O=C(Oc1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1)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(Oc1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1)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 13 of 13 chemicals

4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl 2-methoxybenzoate chemical structure, C22H18N2O5S, CAS 312290-57-6
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl 2-methoxybenzoate
CAS 312290-57-6C22H18N2O5S
4-[(1,1-Dioxo-1H-1,2-benzisothiazol-3-yl)amino]-2-isopropyl-5-methylphenyl 2-fluorobenzoate chemical structure, C24H21FN2O4S, CAS 312536-54-2
4-[(1,1-Dioxo-1H-1,2-benzisothiazol-3-yl)amino]-2-isopropyl-5-methylphenyl 2-fluorobenzoate
CAS 312536-54-2C24H21FN2O4S
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 2-fluorobenzoate chemical structure, C20H13FN2O4S, CAS 312517-38-7
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 2-fluorobenzoate
CAS 312517-38-7C20H13FN2O4S
2-[(Diethylamino)methyl]-4-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl benzoate chemical structure, C25H25N3O4S, CAS 296791-05-4
2-[(Diethylamino)methyl]-4-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl benzoate
CAS 296791-05-4C25H25N3O4S
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 3,4,5-trimethoxybenzoate chemical structure, C23H20N2O7S, CAS 510760-24-4
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 3,4,5-trimethoxybenzoate
CAS 510760-24-4C23H20N2O7S
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl 2,4-dichlorobenzoate chemical structure, C21H14Cl2N2O4S, CAS 339011-82-4
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl 2,4-dichlorobenzoate
CAS 339011-82-4C21H14Cl2N2O4S
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl 2-chlorobenzoate chemical structure, C21H15ClN2O4S, CAS 294877-04-6
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl 2-chlorobenzoate
CAS 294877-04-6C21H15ClN2O4S
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl 3-methylbenzoate chemical structure, C22H18N2O4S, CAS 312285-25-9
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl 3-methylbenzoate
CAS 312285-25-9C22H18N2O4S
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl 2-fluorobenzoate chemical structure, C21H15FN2O4S, CAS 313481-09-3
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)(methyl)amino]phenyl 2-fluorobenzoate
CAS 313481-09-3C21H15FN2O4S
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 2-methylbenzoate chemical structure, C21H16N2O4S, CAS 592467-11-3
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 2-methylbenzoate
CAS 592467-11-3C21H16N2O4S
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]-5-methyl-2-(propan-2-yl)phenyl benzoate chemical structure, C24H22N2O4S, CAS 312282-32-9
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]-5-methyl-2-(propan-2-yl)phenyl benzoate
CAS 312282-32-9C24H22N2O4S
2-[(Diethylamino)methyl]-4-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl 2-bromobenzoate chemical structure, C25H24BrN3O4S, CAS 400823-09-8
2-[(Diethylamino)methyl]-4-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl 2-bromobenzoate
CAS 400823-09-8C25H24BrN3O4S
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate chemical structure, C24H23N3O6S2, CAS 663168-01-2
4-[(1,1-Dioxido-1,2-benzothiazol-3-yl)amino]phenyl 4-(diethylsulfamoyl)benzoate
CAS 663168-01-2C24H23N3O6S2