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Murcko scaffold

Isoquinolin-1-yl(phenyl)methyl benzoate scaffold

13 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
26
Chemicals
13
With full pages
4
Scaffold SMILES

O=C(OC(c1ccccc1)c1nccc2ccccc12)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 scaffoldOpen the Isoquinolin-1-yl(phenyl)methyl benzoate page
Murcko scaffold O=C(OC(c1ccccc1)c1nccc2ccccc12)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-Chlorophenyl)(isoquinolin-1-yl)methyl benzoate chemical structure, C23H16ClNO2, CAS 54923-37-4
(4-Chlorophenyl)(isoquinolin-1-yl)methyl benzoate
CAS 54923-37-4C23H16ClNO2
Isoquinolin-1-yl(phenyl)methyl benzoate chemical structure, C23H17NO2, CAS 5468-02-0
Isoquinolin-1-yl(phenyl)methyl benzoate
CAS 5468-02-0C23H17NO2
(3,4-Dimethoxyphenyl)(isoquinolin-1-yl)methyl benzoate chemical structure, C25H21NO4, CAS 39971-70-5
(3,4-Dimethoxyphenyl)(isoquinolin-1-yl)methyl benzoate
CAS 39971-70-5C25H21NO4
Isoquinolin-1-yl(4-methoxyphenyl)methyl benzoate chemical structure, C24H19NO3, CAS 102665-49-6
Isoquinolin-1-yl(4-methoxyphenyl)methyl benzoate
CAS 102665-49-6C24H19NO3
Isoquinolin-1-yl(phenyl)methyl 3,4-dimethoxybenzoate chemical structure, C25H21NO4, CAS 385786-22-1
Isoquinolin-1-yl(phenyl)methyl 3,4-dimethoxybenzoate
CAS 385786-22-1C25H21NO4
Isoquinolin-1-yl(4-methoxyphenyl)methyl 2-fluorobenzoate chemical structure, C24H18FNO3, CAS 446269-99-4
Isoquinolin-1-yl(4-methoxyphenyl)methyl 2-fluorobenzoate
CAS 446269-99-4C24H18FNO3
Isoquinolin-1-yl(phenyl)methyl 4-nitrobenzoate chemical structure, C23H16N2O4, CAS 307540-49-4
Isoquinolin-1-yl(phenyl)methyl 4-nitrobenzoate
CAS 307540-49-4C23H16N2O4
Isoquinolylphenylmethyl 4-methylbenzoate chemical structure, C24H19NO2, CAS 446270-06-0
Isoquinolylphenylmethyl 4-methylbenzoate
CAS 446270-06-0C24H19NO2
Isoquinolin-1-yl(4-methoxyphenyl)methyl 4-fluorobenzoate chemical structure, C24H18FNO3, CAS 385786-45-8
Isoquinolin-1-yl(4-methoxyphenyl)methyl 4-fluorobenzoate
CAS 385786-45-8C24H18FNO3
Isoquinolin-1-yl(4-methoxyphenyl)methyl 3,4-dimethoxybenzoate chemical structure, C26H23NO5, CAS 446269-97-2
Isoquinolin-1-yl(4-methoxyphenyl)methyl 3,4-dimethoxybenzoate
CAS 446269-97-2C26H23NO5
Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate chemical structure, C24H19NO3, CAS 391876-24-7
Isoquinolin-1-yl(phenyl)methyl 4-methoxybenzoate
CAS 391876-24-7C24H19NO3
Isoquinolin-1-yl(phenyl)methyl 4-(tert-butyl)benzoate chemical structure, C27H25NO2, CAS 391876-25-8
Isoquinolin-1-yl(phenyl)methyl 4-(tert-butyl)benzoate
CAS 391876-25-8C27H25NO2
Isoquinolylphenylmethyl 4-iodobenzoate chemical structure, C23H16INO2, CAS 380217-30-1
Isoquinolylphenylmethyl 4-iodobenzoate
CAS 380217-30-1C23H16INO2