Murcko scaffold
Ring system with 5 rings and 35 atoms
61 chemicals on CompoundList share this ring system.
- Rings
- 5
- Scaffold atoms
- 35
- Chemicals
- 61
- With full pages
- 12
Scaffold SMILES
C1=CC(=C(c2ccccc2)c2ccc(NCc3ccccc3)cc2)C=CC1=NCc1ccccc1
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.
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 61 chemicals
Fast Green FCF
CAS 2353-45-9C37H34N2Na2O10S3
C.I. Acid Blue 9
CAS 2650-18-2C37H42N4O9S3
FD&C Blue No. 1
CAS 3844-45-9C37H34N2Na2O9S3
C.I. Acid Green 3
CAS 4680-78-8C37H35N2NaO6S2
Light green SF yellowish
CAS 5141-20-8C37H34N2Na2O9S3
RefChem:789044
CAS 5863-46-7C42H46N3NaO6S2
![Trisodium, azane, 3-[[N-ethyl-4-[[4-[ethyl-[(3-sulfophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-(2-sulfophenyl)methyl]anilino]methyl]benzenesulfonate, 5-oxo-1-(4-sulfonatophenyl)-4-[(4-sulfonatophenyl)diazenyl]-4H-pyrazole-3-carboxylate chemical structure, C53H51N8Na3O18S5, CAS 92170-50-8](/s/CNXKZKXMIIEMNW-UHFFFAOYSA-K.svg)
Trisodium, azane, 3-[[N-ethyl-4-[[4-[ethyl-[(3-sulfophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-(2-sulfophenyl)methyl]anilino]methyl]benzenesulfonate, 5-oxo-1-(4-sulfonatophenyl)-4-[(4-sulfonatophenyl)diazenyl]-4H-pyrazole-3-carboxylate
CAS 92170-50-8C53H51N8Na3O18S5
Acid Blue 7
CAS 3486-30-4C37H35N2NaO6S2
Acid Blue 7 free acid
CAS 1039452-58-8C37H37N2O6S2+
![3-[[Ethyl-[4-[[4-[ethyl-[(3-sulfophenyl)methyl]amino]phenyl]-phenylmethylidene]cyclohexa-2,5-dien-1-ylidene]azaniumyl]methyl]benzenesulfonate chemical structure, C37H36N2O6S2, CAS 6638-02-4](/s/SRRJCDUOSQWHGS-UHFFFAOYSA-N.svg)
3-[[Ethyl-[4-[[4-[ethyl-[(3-sulfophenyl)methyl]amino]phenyl]-phenylmethylidene]cyclohexa-2,5-dien-1-ylidene]azaniumyl]methyl]benzenesulfonate
CAS 6638-02-4C37H36N2O6S2
Violet BNP
CAS 1313437-37-4C41H44N3NaO6S2
Fast green
CAS 12777-77-4C34H28N2Na2O10S3
Brillant blue
CAS 25305-78-6C37H36N2O9S3
RefChem:563452
CAS 71701-18-3C37H34K2N2O9S3
RefChem:563453
CAS 71701-19-4C37H34KN2NaO9S3
Acid Blue 5
CAS 3374-30-9C37H37N2O7S2+
Benzenemethanaminium, N-ethyl-N-(4-((4-(ethyl((3-sulfophenyl)methyl)amino)phenyl)(4-sulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-3-sulfo-, inner salt
CAS 25305-94-6C37H36N2O9S3
3-(((4-((4-(Diethylamino)phenyl)(4-(ethyl(3-sulfobenzyl)amino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)ammonio)methyl)benzenesulfonate
CAS 25460-30-4C41H45N3O6S2
N-Ethyl-N-(4-((4-(ethyl((3-sulfophenyl)methyl)amino)phenyl)(2-sulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-3-sulfonatobenzenemethanaminium
CAS 68921-42-6C37H36N2O9S3
(4-((2-Chlorophenyl)(4-(ethyl((3-sulphonatophenyl)methyl)ammonio)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)(3-sulphonatobenzyl)ammonium
CAS 25305-97-9C37H35ClN2O6S2
Fast Green free acid
CAS 25738-40-3C37H36N2O10S3
Npc313979
CAS 11096-63-2C37H34ClN2O6S2-
![4-[[4-[[4-(Diethylamino)phenyl]-[4-[ethyl-[(4-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-N-ethylanilino]methyl]benzenesulfonate chemical structure, C41H44N3O6S2-, CAS 5573-22-8](/s/ILEMJEAHFBMGBL-UHFFFAOYSA-M.svg)
4-[[4-[[4-(Diethylamino)phenyl]-[4-[ethyl-[(4-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-N-ethylanilino]methyl]benzenesulfonate
CAS 5573-22-8C41H44N3O6S2-
Acid green 22
CAS 5863-51-4C39H38ClN2NaO6S2
- RefChem:5634286362-40-9C37H33Cl2N2NaO6S2
- Benzenemethanaminium, N-(4-((2,5-disulfophenyl)(4-(ethyl(phenylmethyl)amino)phenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-ethyl-, inner salt, sodium salt66225-56-7C37H35N2NaO6S2
- 1 suppliersFD&C Blue No. 1 aluminum lake15792-67-3C111H102Al2N6O27S9
- Benzenemethanaminium, N-ethyl-N-(4-((4-(ethyl((3-sulfophenyl)methyl)amino)phenyl)phenylmethylene)-2,5-cyclohexadien-1-ylidene)-3-sulfo-, inner salt, barium salt68399-73-5C74H70BaN4O12S4
- Disodium N-ethyl-N-(4-((4-(ethyl((4-sulfophenyl)methyl)amino)phenyl)(4-hydroxy-2-sulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-4-sulfobenzenemethanaminium hydroxide28120-24-3C37H34N2Na2O10S3
- 4-[[4-[Benzyl(ethyl)azaniumylidene]cyclohexa-2,5-dien-1-ylidene]-[4-[benzyl(ethyl)azaniumyl]phenyl]methyl]benzene-1,3-disulfonateC37H36N2O6S2
- 1 suppliersMethyl purple1340-02-9C67H62N8Na4O14S3
- 14 suppliersAcid Green 94857-81-2C37H34ClN2NaO6S2
- Hydrogen (ethyl)(4-(alpha-(4-(ethyl(sulphonatobenzyl)amino)phenyl)benzylidene)cyclohexa-2,5-dien-1-ylidene)(sulphonatobenzyl)ammonium85305-31-3C37H35N2O6S2-
- Hydrogen (ethyl)(4-(alpha-(4-(ethyl(sulphonatobenzyl)amino)phenyl)benzylidene)cyclohexa-2,5-dien-1-ylidene)(sulphonatobenzyl)ammonium, sodium salt85353-70-4C37H35N2NaO6S2
- Hydrogen (4-((2-chlorophenyl)(4-(ethyl(sulphonatobenzyl)amino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)(sulphonatobenzyl)ammonium, sodium salt93893-07-3C37H34ClN2NaO6S2
- Dihydrogen (ethyl)(4-((4-(ethyl(3-sulphonatobenzyl)amino)-o-tolyl)(4-sulphonatophenyl)methylene)-3-methylcyclohexa-2,5-dien-1-ylidene)-3-sulphonatobenzyl)ammonium, sodium salt93918-01-5C39H38N2Na3O9S3+
- Benzenemethanaminium, N-(4-((2-chlorophenyl)(4-(ethyl((3-sulfophenyl)methyl)amino)-2-methylphenyl)methylene)-3-methyl-2,5-cyclohexadien-1-ylidene)-N-ethyl-3-sulfo-, hydroxide, inner salt, aluminum salt84473-90-5C117H114AlCl3N6O18S6
- Food blue No. 1 aluminum lakeC37H36AlN2O9S3
- Hydrogen (4-((2-chlorophenyl)(4-(ethyl(sulphonatobenzyl)amino)-o-tolyl)methylene)-3-methylcyclohexa-2,5-dien-1-ylidene)(ethyl)(sulphonatobenzyl)ammonium, sodium salt93893-06-2C39H38ClN2NaO6S2
- Light green CF yellowish6546-18-5C37H34CaN2O9S3
- Disodium N-ethyl-N-4-((4-(ethyl((4-sulfophenyl)methyl)amino)phenyl)(2-sulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-4-sulfobenzenemethanaminium105666-88-4C37H34N2Na2O9S3
- Benzenemethanaminium, N-ethyl-N-[4-[[4-[ethyl[(4-sulfophenyl)methyl]amino]phenyl]phenylmethylene]-2,5-cyclohexadien-1-ylidene]-4-sulfo-, inner salt16391-92-7C37H36N2O6S2
- Diammonium 2-((4-(ethyl(4-sulfonatobenzyl)amino)phenyl)((4-(ethyl(4-sulfonatobenzyl)iminio)cyclohexa-2,5-dien-1-ylidene)methyl)benzenesulfonate6371-85-3C37H42N4O9S3
- Sodium 3-[[[4-[[4-(ethylamino)-3-methylphenyl]-[3-methyl-4-[[phenyl(sulfo)methyl]amino]phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-methylazaniumyl]methyl]benzenesulfonate5915-63-9C38H38N3NaO6S2
- Disodium N-ethyl-N-(4-((4-(ethyl((3-sulfophenyl)methyl)amino)phenyl)(4-hydroxy-2-sulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-4-sulfobenzenemethanaminium hydroxide34326-33-5C37H34N2Na2O10S3
- Disodium N-ethyl-N-(4-((4-(ethyl((2-sulfophenyl)methyl)amino)phenyl)(4-hydroxy-2-sulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-3-sulfobenzenemethanaminium hydroxide565430-71-9C37H34N2Na2O10S3
- Dihydrogen (ethyl)(4-(4-(ethyl(3-sulphonatobenzyl)amino)-2'-sulphonatobenzhydrylidene)cyclohexa-2,5-dien-1-ylidene)(3-sulphonatobenzyl)ammonium, aluminium sodium salt84473-85-8C37H36AlN2NaO9S3+4
- Trihydrogen tris((4-((2-chlorophenyl)(4-(ethyl(3-sulphonatobenzyl)amino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)(3-sulphonatobenzyl)ammonium), aluminium salt84473-91-6C111H105AlCl3N6O18S6+3
Related scaffolds
Same ring framework with different atoms or bond orders
![Scaffold [N+]=C1C=CC(=C(c2ccc(NCc3ccccc3)cc2)c2ccc(NCc3ccccc3)cc2)C=C1](/scaffold/UPDHGCNDMWUPGQ-UHFFFAOYSA-N/structure.svg)