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Murcko scaffold

Ring system with 3 rings and 19 atoms

38 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
19
Chemicals
38
With full pages
4
Scaffold SMILES

c1ccc(CNc2ccc(-c3ccccc3)s2)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(CNc2ccc(-c3ccccc3)s2)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 38 of 38 chemicals

Ethyl 2-{[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino}-4-methyl-5-(4-nitrophenyl)thiophene-3-carboxylate chemical structure, C24H22F2N2O6S, CAS 308831-94-9
Ethyl 2-{[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino}-4-methyl-5-(4-nitrophenyl)thiophene-3-carboxylate
CAS 308831-94-9C24H22F2N2O6S
Ethyl 4-(bromomethyl)-2-[(2,6-difluorophenyl)methyl-ethoxycarbonylamino]-5-(4-nitrophenyl)thiophene-3-carboxylate chemical structure, C24H21BrF2N2O6S, CAS 308831-95-0
Ethyl 4-(bromomethyl)-2-[(2,6-difluorophenyl)methyl-ethoxycarbonylamino]-5-(4-nitrophenyl)thiophene-3-carboxylate
CAS 308831-95-0C24H21BrF2N2O6S
Ethyl 2-[N-(2,6-difluorobenzyl)-N-ethoxycarbonylamino]-4-[N-(2-methoxyethyl)-N-methylaminomethyl]-5-(4-aminophenyl)thiophene-3-carboxylate chemical structure, C28H33F2N3O5S, CAS 577780-07-5
Ethyl 2-[N-(2,6-difluorobenzyl)-N-ethoxycarbonylamino]-4-[N-(2-methoxyethyl)-N-methylaminomethyl]-5-(4-aminophenyl)thiophene-3-carboxylate
CAS 577780-07-5C28H33F2N3O5S
Ethyl 2-((2,6-difluorobenzyl)(ethoxycarbonyl)amino)-4-(((2-methoxyethyl)(methyl)amino)methyl)-5-(4-(3-methoxyureido)phenyl)thiophene-3-carboxylate chemical structure, C30H36F2N4O7S, CAS 737789-92-3
Ethyl 2-((2,6-difluorobenzyl)(ethoxycarbonyl)amino)-4-(((2-methoxyethyl)(methyl)amino)methyl)-5-(4-(3-methoxyureido)phenyl)thiophene-3-carboxylate
CAS 737789-92-3C30H36F2N4O7S
2-((2,6-Difluorobenzyl)(ethoxycarbonyl)amino)-4-(((2-methoxyethyl)(methyl)amino)methyl)-5-(4-(3-methoxyureido)phenyl)thiophene-3-carboxylic acid chemical structure, C28H32F2N4O7S, CAS 737789-93-4
2-((2,6-Difluorobenzyl)(ethoxycarbonyl)amino)-4-(((2-methoxyethyl)(methyl)amino)methyl)-5-(4-(3-methoxyureido)phenyl)thiophene-3-carboxylic acid
CAS 737789-93-4C28H32F2N4O7S
589Yvn22AG chemical structure, C25H27F2N3O4S, CAS 577780-10-0
589Yvn22AG
CAS 577780-10-0C25H27F2N3O4S
3-Thiophenecarboxylic acid, 2-[[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino]-4-methyl-5-(4-nitrophenyl)- chemical structure, C22H18F2N2O6S, CAS 2566172-33-4
3-Thiophenecarboxylic acid, 2-[[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino]-4-methyl-5-(4-nitrophenyl)-
CAS 2566172-33-4C22H18F2N2O6S
Ethyl 2-(((2,6-difluorophenyl)methyl)(ethoxycarbonyl)amino)-4-((dimethylamino)methyl)-5-(4-nitrophenyl)thiophene-3-carboxylate chemical structure, C26H27F2N3O6S, CAS 1589503-97-8
Ethyl 2-(((2,6-difluorophenyl)methyl)(ethoxycarbonyl)amino)-4-((dimethylamino)methyl)-5-(4-nitrophenyl)thiophene-3-carboxylate
CAS 1589503-97-8C26H27F2N3O6S
2-{[(2,6-Difluorophenyl)methyl](ethoxycarbonyl)amino}-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)thiophene-3-carboxylic acid chemical structure, C24H23F2N3O6S, CAS 1589503-95-6
2-{[(2,6-Difluorophenyl)methyl](ethoxycarbonyl)amino}-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)thiophene-3-carboxylic acid
CAS 1589503-95-6C24H23F2N3O6S
Ethyl 2-[(2,6-difluorophenyl)methyl-ethoxycarbonylamino]-4-[(dimethylamino)methyl]-5-[4-(methoxycarbamoylamino)phenyl]thiophene-3-carboxylate chemical structure, C28H32F2N4O6S, CAS 2716866-47-4
Ethyl 2-[(2,6-difluorophenyl)methyl-ethoxycarbonylamino]-4-[(dimethylamino)methyl]-5-[4-(methoxycarbamoylamino)phenyl]thiophene-3-carboxylate
CAS 2716866-47-4C28H32F2N4O6S
2-[(2,6-Difluorophenyl)methyl-ethoxycarbonylamino]-4-[(dimethylamino)methyl]-5-[4-(methoxycarbamoylamino)phenyl]thiophene-3-carboxylic acid chemical structure, C26H28F2N4O6S, CAS 2716866-49-6
2-[(2,6-Difluorophenyl)methyl-ethoxycarbonylamino]-4-[(dimethylamino)methyl]-5-[4-(methoxycarbamoylamino)phenyl]thiophene-3-carboxylic acid
CAS 2716866-49-6C26H28F2N4O6S
3-Thiophenecarboxylic acid, 5-(4-aminophenyl)-2-[[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino]-4-[(dimethylamino)methyl]-, ethyl ester chemical structure, C26H29F2N3O4S, CAS 2716866-45-2
3-Thiophenecarboxylic acid, 5-(4-aminophenyl)-2-[[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino]-4-[(dimethylamino)methyl]-, ethyl ester
CAS 2716866-45-2C26H29F2N3O4S
Ethyl 4-(bromomethyl)-2-[[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino]-5-[4-[[(1,1-dimethylethoxy)carbonyl]amino]phenyl]-3-thiophenecarboxylate chemical structure, C29H31BrF2N2O6S, CAS 2754392-24-8
Ethyl 4-(bromomethyl)-2-[[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino]-5-[4-[[(1,1-dimethylethoxy)carbonyl]amino]phenyl]-3-thiophenecarboxylate
CAS 2754392-24-8C29H31BrF2N2O6S
Ethyl 2-((2,6-difluorobenzyl)(methoxycarbonyl)amino)-4-((dimethylamino)methyl)-5-(4-nitrophenyl)thiophene-3-carboxylate chemical structure, C25H25F2N3O6S, CAS 2636079-26-8
Ethyl 2-((2,6-difluorobenzyl)(methoxycarbonyl)amino)-4-((dimethylamino)methyl)-5-(4-nitrophenyl)thiophene-3-carboxylate
CAS 2636079-26-8C25H25F2N3O6S
2-((2,6-Difluorobenzyl)amino)-4-((dimethylamino)methyl)-5-(4-nitrophenyl)thiophene-3-carboxylic acid chemical structure, C21H19F2N3O4S, CAS 3009131-53-4
2-((2,6-Difluorobenzyl)amino)-4-((dimethylamino)methyl)-5-(4-nitrophenyl)thiophene-3-carboxylic acid
CAS 3009131-53-4C21H19F2N3O4S
2-[(2,6-Difluorophenyl)methyl-methoxycarbonylamino]-4-[(dimethylamino)methyl]-5-[4-(methoxycarbamoylamino)phenyl]thiophene-3-carboxylic acid chemical structure, C25H26F2N4O6S, CAS 2902790-16-1
2-[(2,6-Difluorophenyl)methyl-methoxycarbonylamino]-4-[(dimethylamino)methyl]-5-[4-(methoxycarbamoylamino)phenyl]thiophene-3-carboxylic acid
CAS 2902790-16-1C25H26F2N4O6S
3-Thiophenecarboxylic acid, 2-[[(2,6-difluorophenyl)methyl][(1-methylethoxy)carbonyl]amino]-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)-, ethyl ester chemical structure, C27H29F2N3O6S, CAS 2636079-27-9
3-Thiophenecarboxylic acid, 2-[[(2,6-difluorophenyl)methyl][(1-methylethoxy)carbonyl]amino]-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)-, ethyl ester
CAS 2636079-27-9C27H29F2N3O6S
3-Thiophenecarboxylic acid, 2-[[(2,6-difluorophenyl)methyl][(1-methylethoxy)carbonyl]amino]-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)- chemical structure, C25H25F2N3O6S, CAS 2636079-30-4
3-Thiophenecarboxylic acid, 2-[[(2,6-difluorophenyl)methyl][(1-methylethoxy)carbonyl]amino]-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)-
CAS 2636079-30-4C25H25F2N3O6S
3-Thiophenecarboxylic acid, 5-(4-aminophenyl)-2-[[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino]-4-methyl-, ethyl ester chemical structure, C24H24F2N2O4S, CAS 2713575-00-7
3-Thiophenecarboxylic acid, 5-(4-aminophenyl)-2-[[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino]-4-methyl-, ethyl ester
CAS 2713575-00-7C24H24F2N2O4S
3-Thiophenecarboxylic acid, 5-(4-aminophenyl)-2-[[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino]-4-[(dimethylamino)methyl]- chemical structure, C24H25F2N3O4S, CAS 2902790-14-9
3-Thiophenecarboxylic acid, 5-(4-aminophenyl)-2-[[(2,6-difluorophenyl)methyl](ethoxycarbonyl)amino]-4-[(dimethylamino)methyl]-
CAS 2902790-14-9C24H25F2N3O4S
2Qjn7WW49A chemical structure, C29H32F2N2O6S, CAS 2754392-23-7
2Qjn7WW49A
CAS 2754392-23-7C29H32F2N2O6S
45FQ9Tsj8Z chemical structure, C26H30FN3O4S, CAS 2754392-26-0
45FQ9Tsj8Z
CAS 2754392-26-0C26H30FN3O4S
89Kmy6yxh3 chemical structure, C31H37F2N3O6S, CAS 2754392-25-9
89Kmy6yxh3
CAS 2754392-25-9C31H37F2N3O6S
3-Thiophenecarboxylic acid, 2-[[(2,6-difluorophenyl)methyl](propoxycarbonyl)amino]-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)-, ethyl ester chemical structure, C27H29F2N3O6S, CAS 2591260-08-9
3-Thiophenecarboxylic acid, 2-[[(2,6-difluorophenyl)methyl](propoxycarbonyl)amino]-4-[(dimethylamino)methyl]-5-(4-nitrophenyl)-, ethyl ester
CAS 2591260-08-9C27H29F2N3O6S