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Murcko scaffold

Ring system with 3 rings and 19 atoms

8 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
19
Chemicals
8
With full pages
1
Scaffold SMILES

O=C(Cc1ccccc1)NC1C(=O)N2CCS(=O)C12

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(Cc1ccccc1)NC1C(=O)N2CCS(=O)C12

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 8 of 8 chemicals

3,3-Dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4-oxide chemical structure, C16H18N2O5S, CAS 34104-15-9
3,3-Dimethyl-7-oxo-6-[(phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4-oxide
CAS 34104-15-9C16H18N2O5S
4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-((phenylacetyl)amino)-(2S,5R,6R)-, 4-oxide chemical structure, C16H18N2O5S, CAS 4052-54-4
4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-((phenylacetyl)amino)-(2S,5R,6R)-, 4-oxide
CAS 4052-54-4C16H18N2O5S
2,2-Dimethyl-6beta-phenylacetamidopenam-3alpha-ol S-oxide chemical structure, C15H18N2O4S, CAS 41536-84-9
2,2-Dimethyl-6beta-phenylacetamidopenam-3alpha-ol S-oxide
CAS 41536-84-9C15H18N2O4S
(2S-(2alpha,4beta,5alpha,6alpha))-3,3-Dimethyl-7-oxo-6-(phenylacetamido)-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid 4-oxide chemical structure, C16H18N2O5S, CAS 72402-09-6
(2S-(2alpha,4beta,5alpha,6alpha))-3,3-Dimethyl-7-oxo-6-(phenylacetamido)-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid 4-oxide
CAS 72402-09-6C16H18N2O5S
[4S-(4Alpha,5beta,6alpha)]-3,3-dimethyl-7-oxo-6-(phenylacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4-oxide chemical structure, C16H18N2O5S, CAS 54773-98-7
[4S-(4Alpha,5beta,6alpha)]-3,3-dimethyl-7-oxo-6-(phenylacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 4-oxide
CAS 54773-98-7C16H18N2O5S
Amoxicillin impurity 16 chemical structure, C16H19N3O6S, CAS 2485704-40-1
Amoxicillin impurity 16
CAS 2485704-40-1C16H19N3O6S
(2S,5R,6R)-3,3-Dimethyl-6-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylacetyl]amino]-4,7-dioxo-4λ4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid chemical structure, C21H27N3O7S, CAS 57605-39-7
(2S,5R,6R)-3,3-Dimethyl-6-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylacetyl]amino]-4,7-dioxo-4λ4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS 57605-39-7C21H27N3O7S
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(aminophenylacetyl)amino]-3,3-dimethyl-7-oxo-, 4-oxide, (2S,5R,6R)- chemical structure, C16H19N3O5S, CAS 40617-98-9
4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[(aminophenylacetyl)amino]-3,3-dimethyl-7-oxo-, 4-oxide, (2S,5R,6R)-
CAS 40617-98-9C16H19N3O5S