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Murcko scaffold

Ring system with 2 rings and 13 atoms

98 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
13
Chemicals
98
With full pages
9
Scaffold SMILES

S=C1NCC=CN1c1ccccc1

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 S=C1NCC=CN1c1ccccc1

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 98 chemicals

2(1H)-Pyrimidinethione, 1-(m-chlorophenyl)-3,4-dihydro-4,4,6-trimethyl- chemical structure, C13H15ClN2S, CAS 37489-49-9
2(1H)-Pyrimidinethione, 1-(m-chlorophenyl)-3,4-dihydro-4,4,6-trimethyl-
CAS 37489-49-9C13H15ClN2S
[3-(4,6,6-Trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)phenyl] acetate chemical structure, C15H18N2O2S, CAS 339197-49-8
[3-(4,6,6-Trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)phenyl] acetate
CAS 339197-49-8C15H18N2O2S
2(1H)-Pyrimidinethione, 1-(p-chlorophenyl)-3,4-dihydro-4,4,6-trimethyl- chemical structure, C13H15ClN2S, CAS 37489-48-8
2(1H)-Pyrimidinethione, 1-(p-chlorophenyl)-3,4-dihydro-4,4,6-trimethyl-
CAS 37489-48-8C13H15ClN2S
3,4-Dihydro-1-(2-hydroxyphenyl)-4,4,6-trimethyl-2(1H)-pyrimidinethione chemical structure, C13H16N2OS, CAS 63704-48-3
3,4-Dihydro-1-(2-hydroxyphenyl)-4,4,6-trimethyl-2(1H)-pyrimidinethione
CAS 63704-48-3C13H16N2OS
3,4-Dihydro-4,4,6-trimethyl-1-(4-methylphenyl)-2(1H)-pyrimidinethione chemical structure, C14H18N2S, CAS 19017-40-4
3,4-Dihydro-4,4,6-trimethyl-1-(4-methylphenyl)-2(1H)-pyrimidinethione
CAS 19017-40-4C14H18N2S
2(1H)-Pyrimidinethione, 1-(2-bromophenyl)-3,4-dihydro-4,4,6-trimethyl- chemical structure, C13H15BrN2S, CAS 116265-94-2
2(1H)-Pyrimidinethione, 1-(2-bromophenyl)-3,4-dihydro-4,4,6-trimethyl-
CAS 116265-94-2C13H15BrN2S
3,4-Dihydro-1-(4-hydroxyphenyl)-4,4,6-trimethyl-2(1H)-pyrimidinethione chemical structure, C13H16N2OS, CAS 37489-46-6
3,4-Dihydro-1-(4-hydroxyphenyl)-4,4,6-trimethyl-2(1H)-pyrimidinethione
CAS 37489-46-6C13H16N2OS
3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione chemical structure, C14H18N2S, CAS 37489-45-5
3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione
CAS 37489-45-5C14H18N2S
2(1H)-Pyrimidinethione, 3,4-dihydro-1-(m-hydroxyphenyl)-4,4,6-trimethyl- chemical structure, C13H16N2OS, CAS 63704-47-2
2(1H)-Pyrimidinethione, 3,4-dihydro-1-(m-hydroxyphenyl)-4,4,6-trimethyl-
CAS 63704-47-2C13H16N2OS
4,5,6-Trimethyl-1-phenyl-3,4-dihydropyrimidine-2(1H)-thione chemical structure, C13H16N2S, CAS 16325-43-2
4,5,6-Trimethyl-1-phenyl-3,4-dihydropyrimidine-2(1H)-thione
CAS 16325-43-2C13H16N2S
1-(2-Methoxyphenyl)-4,4,6-trimethyl-1,4-dihydropyrimidine-2-thiol chemical structure, C14H18N2OS, CAS 42569-89-1
1-(2-Methoxyphenyl)-4,4,6-trimethyl-1,4-dihydropyrimidine-2-thiol
CAS 42569-89-1C14H18N2OS
1-[3-(4,6,6-Trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)phenyl]ethanone chemical structure, C15H18N2OS, CAS 37489-50-2
1-[3-(4,6,6-Trimethyl-2-sulfanylidene-1H-pyrimidin-3-yl)phenyl]ethanone
CAS 37489-50-2C15H18N2OS
1-(3-Methoxyphenyl)-4,4-dimethyl-1,4-dihydropyrimidine-2-thiol chemical structure, C13H16N2OS, CAS 259683-70-0
1-(3-Methoxyphenyl)-4,4-dimethyl-1,4-dihydropyrimidine-2-thiol
CAS 259683-70-0C13H16N2OS
3,4-Dihydro-1-(4-dimethylaminophenyl)-4,4,6-trimethyl-2-pyrimidinethiol chemical structure, C15H21N3S, CAS 63732-03-6
3,4-Dihydro-1-(4-dimethylaminophenyl)-4,4,6-trimethyl-2-pyrimidinethiol
CAS 63732-03-6C15H21N3S
2(1H)-Pyrimidinethione, 1-(o-chlorophenyl)-3,4-dihydro-4,4,6-trimethyl- chemical structure, C13H15ClN2S, CAS 58913-87-4
2(1H)-Pyrimidinethione, 1-(o-chlorophenyl)-3,4-dihydro-4,4,6-trimethyl-
CAS 58913-87-4C13H15ClN2S
RefChem:357150 chemical structure, C13H15N3O2S, CAS 21038-75-5
RefChem:357150
CAS 21038-75-5C13H15N3O2S
Acetophenone, 4'-(1,4-dihydro-2-mercapto-4,4,6-trimethyl)pyrimidinyl- chemical structure, C15H18N2OS, CAS 63990-68-1
Acetophenone, 4'-(1,4-dihydro-2-mercapto-4,4,6-trimethyl)pyrimidinyl-
CAS 63990-68-1C15H18N2OS
2(1H)-Pyrimidinethione, 3,4-dihydro-4,4,6-trimethyl-1-(3-sulfophenyl)- chemical structure, C13H16N2O3S2, CAS 5423-40-5
2(1H)-Pyrimidinethione, 3,4-dihydro-4,4,6-trimethyl-1-(3-sulfophenyl)-
CAS 5423-40-5C13H16N2O3S2
3,4-Dihydro-4,4,6-trimethyl-1-(2-methylphenyl)-2(1H)-pyrimidinethione chemical structure, C14H18N2S, CAS 6268-98-0
3,4-Dihydro-4,4,6-trimethyl-1-(2-methylphenyl)-2(1H)-pyrimidinethione
CAS 6268-98-0C14H18N2S
2-(3,4-Dihydro-4,4,6-trimethyl-2-thioxo-1(2H)-pyrimidinyl)-5-methylbenzenesulfonic acid chemical structure, C14H18N2O3S2, CAS 6281-59-0
2-(3,4-Dihydro-4,4,6-trimethyl-2-thioxo-1(2H)-pyrimidinyl)-5-methylbenzenesulfonic acid
CAS 6281-59-0C14H18N2O3S2
1-(3-Nitrophenyl)-4,4,6-trimethyl-1H,4H-pyrimidine-2-thiol chemical structure, C13H15N3O2S, CAS 37489-52-4
1-(3-Nitrophenyl)-4,4,6-trimethyl-1H,4H-pyrimidine-2-thiol
CAS 37489-52-4C13H15N3O2S
2(1H)-Pyrimidinethione, 1-(2,5-dichlorophenyl)-3,4-dihydro-4,4,6-trimethyl- chemical structure, C13H14Cl2N2S, CAS 63704-45-0
2(1H)-Pyrimidinethione, 1-(2,5-dichlorophenyl)-3,4-dihydro-4,4,6-trimethyl-
CAS 63704-45-0C13H14Cl2N2S
2(1H)-Pyrimidinethione, 3,4-dihydro-4,4,6-trimethyl-1-(p-sulfophenyl)- chemical structure, C13H16N2O3S2, CAS 63704-52-9
2(1H)-Pyrimidinethione, 3,4-dihydro-4,4,6-trimethyl-1-(p-sulfophenyl)-
CAS 63704-52-9C13H16N2O3S2
Benzoic acid, 4-(3,4-dihydro-4,4,6-trimethyl-2-thioxo-1(2H)-pyrimidinyl)- chemical structure, C14H16N2O2S, CAS 68072-55-9
Benzoic acid, 4-(3,4-dihydro-4,4,6-trimethyl-2-thioxo-1(2H)-pyrimidinyl)-
CAS 68072-55-9C14H16N2O2S