CompoundList
Sign in
Murcko scaffold

Ring system with 3 rings and 20 atoms

19 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
20
Chemicals
19
With full pages
15
Scaffold SMILES

O=C(CCNc1ccccc1)c1ccc2c(c1)OCO2

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(CCNc1ccccc1)c1ccc2c(c1)OCO2

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 19 of 19 chemicals

1-(1,3-Benzodioxol-5-yl)-3-(4-bromoanilino)-1-propanone chemical structure, C16H14BrNO3, CAS 720667-79-8
1-(1,3-Benzodioxol-5-yl)-3-(4-bromoanilino)-1-propanone
CAS 720667-79-8C16H14BrNO3
1-(1,3-Benzodioxol-5-yl)-3-(4-ethoxyanilino)-1-propanone chemical structure, C18H19NO4, CAS 717827-75-3
1-(1,3-Benzodioxol-5-yl)-3-(4-ethoxyanilino)-1-propanone
CAS 717827-75-3C18H19NO4
1-(1,3-Benzodioxol-5-yl)-3-(3-nitroanilino)-1-propanone chemical structure, C16H14N2O5, CAS 883793-84-8
1-(1,3-Benzodioxol-5-yl)-3-(3-nitroanilino)-1-propanone
CAS 883793-84-8C16H14N2O5
1-(1,3-Benzodioxol-5-yl)-3-(3-chloro-4-fluoroanilino)-1-propanone chemical structure, C16H13ClFNO3, CAS 883794-86-3
1-(1,3-Benzodioxol-5-yl)-3-(3-chloro-4-fluoroanilino)-1-propanone
CAS 883794-86-3C16H13ClFNO3
1-(1,3-Benzodioxol-5-yl)-3-(4-ethylanilino)-1-propanone chemical structure, C18H19NO3, CAS 477320-40-4
1-(1,3-Benzodioxol-5-yl)-3-(4-ethylanilino)-1-propanone
CAS 477320-40-4C18H19NO3
1-(1,3-Benzodioxol-5-yl)-3-(4-iodoanilino)-1-propanone chemical structure, C16H14INO3, CAS 883794-43-2
1-(1,3-Benzodioxol-5-yl)-3-(4-iodoanilino)-1-propanone
CAS 883794-43-2C16H14INO3
1-(1,3-Benzodioxol-5-yl)-3-(4-fluoroanilino)-1-propanone chemical structure, C16H14FNO3, CAS 477320-48-2
1-(1,3-Benzodioxol-5-yl)-3-(4-fluoroanilino)-1-propanone
CAS 477320-48-2C16H14FNO3
1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-3-nitroanilino)-1-propanone chemical structure, C16H13ClN2O5, CAS 892155-46-3
1-(1,3-Benzodioxol-5-yl)-3-(4-chloro-3-nitroanilino)-1-propanone
CAS 892155-46-3C16H13ClN2O5
1-(1,3-Benzodioxol-5-yl)-3-[4-(sec-butyl)anilino]-1-propanone chemical structure, C20H23NO3, CAS 882748-28-9
1-(1,3-Benzodioxol-5-yl)-3-[4-(sec-butyl)anilino]-1-propanone
CAS 882748-28-9C20H23NO3
1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyanilino)-1-propanone chemical structure, C17H16ClNO4, CAS 477328-94-2
1-(1,3-Benzodioxol-5-yl)-3-(5-chloro-2-methoxyanilino)-1-propanone
CAS 477328-94-2C17H16ClNO4
1-(1,3-Benzodioxol-5-yl)-3-(3-fluoro-4-methylanilino)-1-propanone chemical structure, C17H16FNO3, CAS 882748-81-4
1-(1,3-Benzodioxol-5-yl)-3-(3-fluoro-4-methylanilino)-1-propanone
CAS 882748-81-4C17H16FNO3
1-(1,3-Benzodioxol-5-yl)-3-(3,4-dichloroanilino)-1-propanone chemical structure, C16H13Cl2NO3, CAS 892155-51-0
1-(1,3-Benzodioxol-5-yl)-3-(3,4-dichloroanilino)-1-propanone
CAS 892155-51-0C16H13Cl2NO3
1-(1,3-Benzodioxol-5-yl)-3-(3-chloro-4-methylanilino)-1-propanone chemical structure, C17H16ClNO3, CAS 477334-02-4
1-(1,3-Benzodioxol-5-yl)-3-(3-chloro-4-methylanilino)-1-propanone
CAS 477334-02-4C17H16ClNO3
1-(1,3-Benzodioxol-5-yl)-3-(3,4-dimethylanilino)-1-propanone chemical structure, C18H19NO3, CAS 477319-12-3
1-(1,3-Benzodioxol-5-yl)-3-(3,4-dimethylanilino)-1-propanone
CAS 477319-12-3C18H19NO3
1-(1,3-Benzodioxol-5-yl)-3-(2,4-dimethoxyanilino)-1-propanone chemical structure, C18H19NO5, CAS 477319-03-2
1-(1,3-Benzodioxol-5-yl)-3-(2,4-dimethoxyanilino)-1-propanone
CAS 477319-03-2C18H19NO5
1-(1,3-Benzodioxol-5-yl)-3-(4-methoxyanilino)-1-propanone chemical structure, C17H17NO4, CAS 477333-83-8
1-(1,3-Benzodioxol-5-yl)-3-(4-methoxyanilino)-1-propanone
CAS 477333-83-8C17H17NO4
1-(1,3-Benzodioxol-5-yl)-3-(4-chloroanilino)-1-propanone chemical structure, C16H14ClNO3, CAS 882748-32-5
1-(1,3-Benzodioxol-5-yl)-3-(4-chloroanilino)-1-propanone
CAS 882748-32-5C16H14ClNO3
1-(1,3-Benzodioxol-5-yl)-3-(4-(trifluoromethyl)anilino)-1-propanone chemical structure, C17H14F3NO3, CAS 477334-18-2
1-(1,3-Benzodioxol-5-yl)-3-(4-(trifluoromethyl)anilino)-1-propanone
CAS 477334-18-2C17H14F3NO3
1-(1,3-Benzodioxol-5-yl)-3-(4-isopropylanilino)-1-propanone chemical structure, C19H21NO3, CAS 477334-25-1
1-(1,3-Benzodioxol-5-yl)-3-(4-isopropylanilino)-1-propanone
CAS 477334-25-1C19H21NO3