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Murcko scaffold

Ring system with 5 rings and 31 atoms

165 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
31
Chemicals
165
With full pages
8
Scaffold SMILES

O=C(CSc1nc(-c2ccccc2)nc2c1Cc1ccncc1O2)Nc1ccccc1

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(CSc1nc(-c2ccccc2)nc2c1Cc1ccncc1O2)Nc1ccccc1

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 48 of 165 chemicals

2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(p-tolyl)acetamide chemical structure, C28H26N4O4S, CAS 867040-57-1
2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(p-tolyl)acetamide
CAS 867040-57-1C28H26N4O4S
2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(m-tolyl)acetamide chemical structure, C28H26N4O4S, CAS 867040-58-2
2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(m-tolyl)acetamide
CAS 867040-58-2C28H26N4O4S
2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(o-tolyl)acetamide chemical structure, C28H26N4O4S, CAS 867040-59-3
2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(o-tolyl)acetamide
CAS 867040-59-3C28H26N4O4S
N-(2,3-Dimethylphenyl)-2-((6-(hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)acetamide chemical structure, C29H28N4O4S, CAS 867040-60-6
N-(2,3-Dimethylphenyl)-2-((6-(hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)acetamide
CAS 867040-60-6C29H28N4O4S
N-(2,5-Dimethylphenyl)-2-((6-(hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)acetamide chemical structure, C29H28N4O4S, CAS 867040-61-7
N-(2,5-Dimethylphenyl)-2-((6-(hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)acetamide
CAS 867040-61-7C29H28N4O4S
N-(2,6-Dimethylphenyl)-2-((6-(hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)acetamide chemical structure, C29H28N4O4S, CAS 867040-62-8
N-(2,6-Dimethylphenyl)-2-((6-(hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)acetamide
CAS 867040-62-8C29H28N4O4S
2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-mesitylacetamide chemical structure, C30H30N4O4S, CAS 867040-63-9
2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-mesitylacetamide
CAS 867040-63-9C30H30N4O4S
2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(2-methoxyphenyl)acetamide chemical structure, C28H26N4O5S, CAS 867040-64-0
2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(2-methoxyphenyl)acetamide
CAS 867040-64-0C28H26N4O5S
2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(4-methoxyphenyl)acetamide chemical structure, C28H26N4O5S, CAS 867040-65-1
2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(4-methoxyphenyl)acetamide
CAS 867040-65-1C28H26N4O5S
N-(2-Chlorophenyl)-2-((6-(hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)acetamide chemical structure, C27H23ClN4O4S, CAS 867040-66-2
N-(2-Chlorophenyl)-2-((6-(hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)acetamide
CAS 867040-66-2C27H23ClN4O4S
N-(3-Chlorophenyl)-2-((6-(hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)acetamide chemical structure, C27H23ClN4O4S, CAS 867040-67-3
N-(3-Chlorophenyl)-2-((6-(hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)acetamide
CAS 867040-67-3C27H23ClN4O4S
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(p-tolyl)acetamide chemical structure, C27H23ClN4O3S, CAS 867040-68-4
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(p-tolyl)acetamide
CAS 867040-68-4C27H23ClN4O3S
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(o-tolyl)acetamide chemical structure, C27H23ClN4O3S, CAS 867040-70-8
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(o-tolyl)acetamide
CAS 867040-70-8C27H23ClN4O3S
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(2,6-dimethylphenyl)acetamide chemical structure, C28H25ClN4O3S, CAS 867040-71-9
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(2,6-dimethylphenyl)acetamide
CAS 867040-71-9C28H25ClN4O3S
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-mesitylacetamide chemical structure, C29H27ClN4O3S, CAS 867040-72-0
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-mesitylacetamide
CAS 867040-72-0C29H27ClN4O3S
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(3,4-dimethylphenyl)acetamide chemical structure, C28H25ClN4O3S, CAS 867040-73-1
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(3,4-dimethylphenyl)acetamide
CAS 867040-73-1C28H25ClN4O3S
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(3-methoxyphenyl)acetamide chemical structure, C27H23ClN4O4S, CAS 867040-74-2
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(3-methoxyphenyl)acetamide
CAS 867040-74-2C27H23ClN4O4S
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(4-methoxyphenyl)acetamide chemical structure, C27H23ClN4O4S, CAS 867040-75-3
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(4-methoxyphenyl)acetamide
CAS 867040-75-3C27H23ClN4O4S
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(4-ethoxyphenyl)acetamide chemical structure, C28H25ClN4O4S, CAS 867040-76-4
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(4-ethoxyphenyl)acetamide
CAS 867040-76-4C28H25ClN4O4S
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(4-fluorophenyl)acetamide chemical structure, C26H20ClFN4O3S, CAS 867040-77-5
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(4-fluorophenyl)acetamide
CAS 867040-77-5C26H20ClFN4O3S
2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(4-isopropylphenyl)acetamide chemical structure, C30H30N4O4S, CAS 867040-78-6
2-((6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(4-isopropylphenyl)acetamide
CAS 867040-78-6C30H30N4O4S
2-[[6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[1,2]pyrano[2,4-b]pyrimidin-4-yl]sulfanyl]-N-(3-hydroxyphenyl)acetamide chemical structure, C27H24N4O5S, CAS 892382-48-8
2-[[6-(Hydroxymethyl)-2-(4-methoxyphenyl)-9-methyl-5H-pyrido[1,2]pyrano[2,4-b]pyrimidin-4-yl]sulfanyl]-N-(3-hydroxyphenyl)acetamide
CAS 892382-48-8C27H24N4O5S
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(2,3-dimethylphenyl)acetamide chemical structure, C28H25ClN4O3S, CAS 892382-66-0
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(2,3-dimethylphenyl)acetamide
CAS 892382-66-0C28H25ClN4O3S
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(2,5-dimethylphenyl)acetamide chemical structure, C28H25ClN4O3S, CAS 892382-69-3
2-((2-(2-Chlorophenyl)-6-(hydroxymethyl)-9-methyl-5H-pyrido[4',3':5,6]pyrano[2,3-d]pyrimidin-4-yl)thio)-N-(2,5-dimethylphenyl)acetamide
CAS 892382-69-3C28H25ClN4O3S