CompoundList
Murcko scaffold

Ring system with 4 rings and 21 atoms

15 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
21
Chemicals
15
With full pages
3
Scaffold SMILES

O=C(Nc1ccccc1)c1cc2cc3c(nc2s1)CCC3

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.

Murcko scaffold O=C(Nc1ccccc1)c1cc2cc3c(nc2s1)CCC3

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 15 of 15 chemicals

3-Amino-N-(2,3-dimethylphenyl)-6,7-dihydro-5H-cyclopenta[B]thieno[3,2-E]pyridine-2-carboxamide chemical structure, C19H19N3OS, CAS 309741-89-7
3-Amino-N-(2,3-dimethylphenyl)-6,7-dihydro-5H-cyclopenta[B]thieno[3,2-E]pyridine-2-carboxamide
CAS 309741-89-7C19H19N3OS
RefChem:381457 chemical structure, C17H15N3OS, CAS 6244-21-9
RefChem:381457
CAS 6244-21-9C17H15N3OS
3-Amino-N-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide chemical structure, C17H14FN3OS, CAS 354793-61-6
3-Amino-N-(2-fluorophenyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
CAS 354793-61-6C17H14FN3OS
3-Amino-N-(4-methylphenyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide chemical structure, C18H17N3OS, CAS 354793-59-2
3-Amino-N-(4-methylphenyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
CAS 354793-59-2C18H17N3OS
3-Amino-N-(4-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide chemical structure, C17H14ClN3OS, CAS 428444-64-8
3-Amino-N-(4-chlorophenyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
CAS 428444-64-8C17H14ClN3OS
3-Amino-N-(4-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide chemical structure, C18H17N3O2S, CAS 340813-04-9
3-Amino-N-(4-methoxyphenyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
CAS 340813-04-9C18H17N3O2S
3-Amino-N-[2-(trifluoromethyl)phenyl]-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide chemical structure, C18H14F3N3OS, CAS 445384-37-2
3-Amino-N-[2-(trifluoromethyl)phenyl]-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
CAS 445384-37-2C18H14F3N3OS
3-Amino-N-(4-bromo-2-methylphenyl)-4-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide chemical structure, C19H15BrF3N3OS, CAS 626228-80-6
3-Amino-N-(4-bromo-2-methylphenyl)-4-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
CAS 626228-80-6C19H15BrF3N3OS
3-Amino-N-(3-chloro-4-fluorophenyl)-4-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide chemical structure, C18H12ClF4N3OS, CAS 626227-22-3
3-Amino-N-(3-chloro-4-fluorophenyl)-4-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
CAS 626227-22-3C18H12ClF4N3OS
3-Amino-N-[4-(methylsulfanyl)phenyl]-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide chemical structure, C18H17N3OS2, CAS 665000-91-9
3-Amino-N-[4-(methylsulfanyl)phenyl]-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
CAS 665000-91-9C18H17N3OS2
DC_AC50 chemical structure, C17H12BrF2N3OS, CAS 497061-48-0
DC_AC50
CAS 497061-48-0C17H12BrF2N3OS
6-Amino-N-(3-cyanophenyl)-8-(trifluoromethyl)-4-thia-2-azatricyclo[7.3.0.0^{3,7}]dodeca-1(9),2,5,7-tetraene-5-carboxamide chemical structure, C19H13F3N4OS, CAS 626222-18-2
6-Amino-N-(3-cyanophenyl)-8-(trifluoromethyl)-4-thia-2-azatricyclo[7.3.0.0^{3,7}]dodeca-1(9),2,5,7-tetraene-5-carboxamide
CAS 626222-18-2C19H13F3N4OS
3-Amino-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide chemical structure, C18H12Cl2F3N3OS, CAS 626227-29-0
3-Amino-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
CAS 626227-29-0C18H12Cl2F3N3OS
3-Amino-N-(2-chloro-5-(trifluoromethyl)phenyl)-6,7-dihydro-5H-cyclopenta(B)thieno(3,2-E)pyridine-2-carboxamide chemical structure, C18H13ClF3N3OS, CAS 400864-40-6
3-Amino-N-(2-chloro-5-(trifluoromethyl)phenyl)-6,7-dihydro-5H-cyclopenta(B)thieno(3,2-E)pyridine-2-carboxamide
CAS 400864-40-6C18H13ClF3N3OS
3-Amino-N-(4-nitrophenyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide chemical structure, C17H14N4O3S, CAS 361198-39-2
3-Amino-N-(4-nitrophenyl)-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
CAS 361198-39-2C17H14N4O3S