Murcko scaffold

[2-Imino-5-oxo-1-benzyl(1,6-dihydropyridino[1,2-a]pyridino[2,3-d]pyrimidin-3-y l)]-N-(oxolan-2-ylmethyl)carboxamide scaffold

11 chemicals on CompoundList share this ring system.

Rings: 5
Scaffold atoms: 32
Chemicals: 11
With full pages: 8

Scaffold SMILES

N=c1c(C(=O)NCC2CCCO2)cc2c(=O)n3ccccc3nc2n1Cc1ccccc1

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 Open the [2-Imino-5-oxo-1-benzyl(1,6-dihydropyridino[1,2-a]pyridino[2,3-d]pyrimidin-3-y l)]-N-(oxolan-2-ylmethyl)carboxamide page

Murcko scaffold N=c1c(C(=O)NCC2CCCO2)cc2c(=O)n3ccccc3nc2n1Cc1ccccc1

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 11 of 11 chemicals

$7-Benzyl-6-imino-13-methyl-2-oxo-N-[(oxolan-2-yl)methyl]-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide chemical structure, C25H25N5O3, CAS 842961-75-5$

7-Benzyl-6-imino-13-methyl-2-oxo-N-[(oxolan-2-yl)methyl]-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide

CAS 842961-75-5C₂₅H₂₅N₅O₃

2-Imino-1-[(4-methylphenyl)methyl]-5-oxo-N-(2-oxolanylmethyl)-3-dipyrido[1,2-d:3',4'-f]pyrimidinecarboxamide

CAS 573933-87-6C₂₅H₂₅N₅O₃

$7-[(4-Fluorophenyl)methyl]-6-imino-11-methyl-2-oxo-N-[(oxolan-2-yl)methyl]-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide chemical structure, C25H24FN5O3, CAS 848671-65-8$

7-[(4-Fluorophenyl)methyl]-6-imino-11-methyl-2-oxo-N-[(oxolan-2-yl)methyl]-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide

CAS 848671-65-8C₂₅H₂₄FN₅O₃

[2-Imino-5-oxo-1-benzyl(1,6-dihydropyridino[1,2-a]pyridino[2,3-d]pyrimidin-3-y l)]-N-(oxolan-2-ylmethyl)carboxamide

CAS 371133-55-0C₂₄H₂₃N₅O₃

[2-Imino-10-methyl-5-oxo-1-benzyl(1,6-dihydropyridino[2,3-d]pyridino[1,2-a]pyr imidin-3-yl)]-N-(oxolan-2-ylmethyl)carboxamide

CAS 797798-62-0C₂₅H₂₅N₅O₃

1-(2-Chlorobenzyl)-2-imino-5-keto-N-(tetrahydrofurfuryl)dipyrido[1,2-d:3'',4''-f]pyrimidine-3-carboxamide

CAS 877808-66-7C₂₄H₂₂ClN₅O₃

2-Azanylidene-1-[(4-methoxyphenyl)methyl]-5-oxidanylidene-N-(oxolan-2-ylmethyl)dipyrido[1,2-d:3'',4''-f]pyrimidine-3-carboxamide

CAS 858750-74-0C₂₅H₂₅N₅O₄

1-(4-Fluorobenzyl)-2-imino-5-oxo-N-(tetrahydro-2-furanylmethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide

CAS 850752-71-5C₂₄H₂₂FN₅O₃

2-Imino-10-methyl-1-(4-methylbenzyl)-5-oxo-N-(tetrahydrofuran-2-ylmethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxamide

CAS 608104-35-4C₂₆H₂₇N₅O₃

$7-[(4-Chlorophenyl)methyl]-6-imino-2-oxo-N-[(oxolan-2-yl)methyl]-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide chemical structure, C24H22ClN5O3, CAS 893702-58-4$

7-[(4-Chlorophenyl)methyl]-6-imino-2-oxo-N-[(oxolan-2-yl)methyl]-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carboxamide

CAS 893702-58-4C₂₄H₂₂ClN₅O₃

2-Imino-1-(4-methoxybenzyl)-10-methyl-5-oxo-N-(tetrahydro-2-furanylmethyl)-1,5-dihydro-2H-dipyrido[1,2-a:2,3-d]pyrimidine-3-carboxamide

CAS 919226-93-0C₂₆H₂₇N₅O₄

[2-Imino-5-oxo-1-benzyl(1,6-dihydropyridino[1,2-a]pyridino[2,3-d]pyrimidin-3-y l)]-N-(oxolan-2-ylmethyl)carboxamide scaffold

Chemicals with this scaffold

Related scaffolds