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Murcko scaffold

Ring system with 3 rings and 15 atoms

7 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
15
Chemicals
7
With full pages
3
Scaffold SMILES

c1ccc2c(c1)CSc1ccccc1O2

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 c1ccc2c(c1)CSc1ccccc1O2

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 7 of 7 chemicals

11H-Dibenz(b,f)-1,4-oxathiepin-11-propanamine, N,N-dimethyl-, ethanedioate, hydrate (2:2:1) chemical structure, C20H23NO5S, CAS 82387-05-1
11H-Dibenz(b,f)-1,4-oxathiepin-11-propanamine, N,N-dimethyl-, ethanedioate, hydrate (2:2:1)
CAS 82387-05-1C20H23NO5S
11H-Dibenz(b,f)-1,4-oxathiepin-11-propanamine, 2-chloro-N,N-dimethyl-, ethanedioate chemical structure, C20H22ClNO5S, CAS 82387-07-3
11H-Dibenz(b,f)-1,4-oxathiepin-11-propanamine, 2-chloro-N,N-dimethyl-, ethanedioate
CAS 82387-07-3C20H22ClNO5S
2-(11H-Dibenzo[b,f][1,4]oxathiepin-11-yl)-N-methylethanamine chemical structure, C16H17NOS, CAS 82387-08-4
2-(11H-Dibenzo[b,f][1,4]oxathiepin-11-yl)-N-methylethanamine
CAS 82387-08-4C16H17NOS
11H-Dibenz(b,e)(1,4)oxathiepin-11-propanamine, 2-chloro-N,N,11-trimethyl-, ethanedioate (1:1) chemical structure, C21H24ClNO5S, CAS 83986-10-1
11H-Dibenz(b,e)(1,4)oxathiepin-11-propanamine, 2-chloro-N,N,11-trimethyl-, ethanedioate (1:1)
CAS 83986-10-1C21H24ClNO5S
11H-Dibenz(b,f)-1,4-oxathiepin-11-ethanamine, N,N-dimethyl-, ethanedioate chemical structure, C19H21NO5S, CAS 82387-03-9
11H-Dibenz(b,f)-1,4-oxathiepin-11-ethanamine, N,N-dimethyl-, ethanedioate
CAS 82387-03-9C19H21NO5S
11H-Dibenz(b,f)-1,4-oxathiepin-11-propanamine, N-methyl-, ethanedioate chemical structure, C19H21NO5S, CAS 82387-11-9
11H-Dibenz(b,f)-1,4-oxathiepin-11-propanamine, N-methyl-, ethanedioate
CAS 82387-11-9C19H21NO5S
11H-Dibenz(b,f)-1,4-oxathiepin-11-ethanamine, N-methyl-, ethanedioate chemical structure, C18H19NO5S, CAS 82387-09-5
11H-Dibenz(b,f)-1,4-oxathiepin-11-ethanamine, N-methyl-, ethanedioate
CAS 82387-09-5C18H19NO5S