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Murcko scaffold

Ring system with 3 rings and 16 atoms

18 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
16
Chemicals
18
With full pages
5
Scaffold SMILES

c1ccc(-n2ccc(-c3cscn3)c2)cc1

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 c1ccc(-n2ccc(-c3cscn3)c2)cc1

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 18 of 18 chemicals

Methyl 4-[3-(2-amino-1,3-thiazol-4-yl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoate chemical structure, C17H17N3O2S, CAS 750599-09-8
Methyl 4-[3-(2-amino-1,3-thiazol-4-yl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoate
CAS 750599-09-8C17H17N3O2S
4-(2,5-Dimethyl-1-phenyl-1H-pyrrol-3-yl)-1,3-thiazol-2-amine chemical structure, C15H15N3S, CAS 716376-57-7
4-(2,5-Dimethyl-1-phenyl-1H-pyrrol-3-yl)-1,3-thiazol-2-amine
CAS 716376-57-7C15H15N3S
4-[2,5-Dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]-1,3-thiazol-2-amine chemical structure, C16H17N3S, CAS 900641-67-0
4-[2,5-Dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]-1,3-thiazol-2-amine
CAS 900641-67-0C16H17N3S
4-[1-(4-Fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine chemical structure, C15H14FN3S, CAS 379240-65-0
4-[1-(4-Fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine
CAS 379240-65-0C15H14FN3S
4-[1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine chemical structure, C16H17N3OS, CAS 733030-58-5
4-[1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine
CAS 733030-58-5C16H17N3OS
4-[1-(3,4-Dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine chemical structure, C15H13Cl2N3S, CAS 733030-76-7
4-[1-(3,4-Dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine
CAS 733030-76-7C15H13Cl2N3S
4-{2,5-Dimethyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}-1,3-thiazol-2-amine chemical structure, C16H14F3N3S, CAS 733031-15-7
4-{2,5-Dimethyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}-1,3-thiazol-2-amine
CAS 733031-15-7C16H14F3N3S
4-[3-(2-Amino-4-thiazolyl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoic acid chemical structure, C16H15N3O2S, CAS 733031-25-9
4-[3-(2-Amino-4-thiazolyl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoic acid
CAS 733031-25-9C16H15N3O2S
4-[2,5-Dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]-1,3-thiazol-2-amine hydrochloride chemical structure, C16H18ClN3S, CAS 1049726-50-2
4-[2,5-Dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]-1,3-thiazol-2-amine hydrochloride
CAS 1049726-50-2C16H18ClN3S
4-(2,5-Dimethyl-1-phenyl-1H-pyrrol-3-yl)-1,3-thiazol-2-amine hydrochloride chemical structure, C15H16ClN3S, CAS 1052550-77-2
4-(2,5-Dimethyl-1-phenyl-1H-pyrrol-3-yl)-1,3-thiazol-2-amine hydrochloride
CAS 1052550-77-2C15H16ClN3S
Methyl 4-[3-(2-amino-1,3-thiazol-4-yl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoate hydrochloride chemical structure, C17H18ClN3O2S, CAS 1172047-05-0
Methyl 4-[3-(2-amino-1,3-thiazol-4-yl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoate hydrochloride
CAS 1172047-05-0C17H18ClN3O2S
4-[1-(3,4-Dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine hydrochloride chemical structure, C15H14Cl3N3S, CAS 1170210-77-1
4-[1-(3,4-Dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine hydrochloride
CAS 1170210-77-1C15H14Cl3N3S
4-[1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine hydrochloride chemical structure, C16H18ClN3OS, CAS 1171065-61-4
4-[1-(4-Methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine hydrochloride
CAS 1171065-61-4C16H18ClN3OS
4-[1-(4-Fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine hydrochloride chemical structure, C15H15ClFN3S, CAS 1156039-78-9
4-[1-(4-Fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1,3-thiazol-2-amine hydrochloride
CAS 1156039-78-9C15H15ClFN3S
4-{2,5-Dimethyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}-1,3-thiazol-2-amine hydrochloride chemical structure, C16H15ClF3N3S, CAS 1172928-96-9
4-{2,5-Dimethyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}-1,3-thiazol-2-amine hydrochloride
CAS 1172928-96-9C16H15ClF3N3S
Methyl 4-[3-[2-[[(Z)-4-amino-3-cyano-4-oxobut-2-en-2-yl]amino]-1,3-thiazol-4-yl]-2,5-dimethylpyrrol-1-yl]benzoate chemical structure, C22H21N5O3S, CAS 871804-20-5
Methyl 4-[3-[2-[[(Z)-4-amino-3-cyano-4-oxobut-2-en-2-yl]amino]-1,3-thiazol-4-yl]-2,5-dimethylpyrrol-1-yl]benzoate
CAS 871804-20-5C22H21N5O3S
4-[3-(2-{[(tert-Butoxy)carbonyl]amino}-1,3-thiazol-4-yl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoic acid chemical structure, C21H23N3O4S, CAS 2639405-68-6
4-[3-(2-{[(tert-Butoxy)carbonyl]amino}-1,3-thiazol-4-yl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoic acid
CAS 2639405-68-6C21H23N3O4S
Ethyl 4-[3-(2-amino-1,3-thiazol-4-yl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoate chemical structure, C18H19N3O2S, CAS 2639431-50-6
Ethyl 4-[3-(2-amino-1,3-thiazol-4-yl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoate
CAS 2639431-50-6C18H19N3O2S