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Murcko scaffold

2-Benzylisoquinolinium scaffold

25 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
17
Chemicals
25
With full pages
3
Scaffold SMILES

c1ccc(C[n+]2ccc3ccccc3c2)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 scaffoldOpen the 2-Benzylisoquinolinium page
Murcko scaffold c1ccc(C[n+]2ccc3ccccc3c2)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 25 of 25 chemicals

Isoquinolinium, 2-(phenylmethyl)-, chloride (1:1) chemical structure, C16H14ClN, CAS 35674-56-7
Isoquinolinium, 2-(phenylmethyl)-, chloride (1:1)
CAS 35674-56-7C16H14ClN
2-Benzylisoquinolinium chemical structure, C16H14N+, CAS 38602-73-2
2-Benzylisoquinolinium
CAS 38602-73-2C16H14N+
Isoquinolinium, 5-nitro-2-(phenylmethyl)- chemical structure, C16H13N2O2+, CAS 52166-52-6
Isoquinolinium, 5-nitro-2-(phenylmethyl)-
CAS 52166-52-6C16H13N2O2+
2-Benzylisoquinolin-2-ium bromide chemical structure, C16H14BrN, CAS 23277-04-5
2-Benzylisoquinolin-2-ium bromide
CAS 23277-04-5C16H14BrN
Agn-PC-00itnx chemical structure, C16H13BrN2O2, CAS 57249-08-8
Agn-PC-00itnx
CAS 57249-08-8C16H13BrN2O2
2-[(4-Nitrophenyl)methyl]isoquinolin-2-ium bromide chemical structure, C16H13BrN2O2, CAS 16726-82-2
2-[(4-Nitrophenyl)methyl]isoquinolin-2-ium bromide
CAS 16726-82-2C16H13BrN2O2
2-Benzylisoquinolinium perchlorate chemical structure, C16H14ClNO4, CAS 20335-77-7
2-Benzylisoquinolinium perchlorate
CAS 20335-77-7C16H14ClNO4
2-[(4-Methylphenyl)methyl]-5-nitroisoquinolin-2-ium bromide chemical structure, C17H15BrN2O2, CAS 62162-90-7
2-[(4-Methylphenyl)methyl]-5-nitroisoquinolin-2-ium bromide
CAS 62162-90-7C17H15BrN2O2
2-[(4-Methoxyphenyl)methyl]-5-nitroisoquinolin-2-ium bromide chemical structure, C17H15BrN2O3, CAS 62162-89-4
2-[(4-Methoxyphenyl)methyl]-5-nitroisoquinolin-2-ium bromide
CAS 62162-89-4C17H15BrN2O3
2-Benzylisoquinolin-2-ium iodide chemical structure, C16H14IN, CAS 15787-39-0
2-Benzylisoquinolin-2-ium iodide
CAS 15787-39-0C16H14IN
2-({4-[Bis(2-chloroethyl)amino]phenyl}methyl)isoquinolin-2-ium 4-methylbenzene-1-sulfonate chemical structure, C27H28Cl2N2O3S, CAS 5563-12-2
2-({4-[Bis(2-chloroethyl)amino]phenyl}methyl)isoquinolin-2-ium 4-methylbenzene-1-sulfonate
CAS 5563-12-2C27H28Cl2N2O3S
2-[(4-Bromophenyl)methyl]-5-nitroisoquinolin-2-ium bromide chemical structure, C16H12Br2N2O2, CAS 62162-91-8
2-[(4-Bromophenyl)methyl]-5-nitroisoquinolin-2-ium bromide
CAS 62162-91-8C16H12Br2N2O2
2-[(4-Methoxyphenyl)methyl]isoquinolin-2-ium bromide chemical structure, C17H16BrNO, CAS 27415-58-3
2-[(4-Methoxyphenyl)methyl]isoquinolin-2-ium bromide
CAS 27415-58-3C17H16BrNO
2-Benzyl-5-chloroisoquinolin-2-ium bromide chemical structure, C16H13BrClN, CAS 2657772-85-3
2-Benzyl-5-chloroisoquinolin-2-ium bromide
CAS 2657772-85-3C16H13BrClN
5-Amino-2-benzylisoquinolin-2-ium perchlorate chemical structure, C16H15ClN2O4, CAS 57249-04-4
5-Amino-2-benzylisoquinolin-2-ium perchlorate
CAS 57249-04-4C16H15ClN2O4
2-[(2,5-Dihydroxy-4-methylphenyl)methyl]isoquinolin-2-ium chloride chemical structure, C17H16ClNO2, CAS 179192-16-6
2-[(2,5-Dihydroxy-4-methylphenyl)methyl]isoquinolin-2-ium chloride
CAS 179192-16-6C17H16ClNO2
2-[(1S)-1-Phenylethyl]isoquinolin-2-ium chloride chemical structure, C17H16ClN, CAS 682153-65-7
2-[(1S)-1-Phenylethyl]isoquinolin-2-ium chloride
CAS 682153-65-7C17H16ClN
2-[(4-Cyanophenyl)methyl]-5-nitroisoquinolin-2-ium bromide chemical structure, C17H12BrN3O2, CAS 62162-96-3
2-[(4-Cyanophenyl)methyl]-5-nitroisoquinolin-2-ium bromide
CAS 62162-96-3C17H12BrN3O2
2-[(3-Cyanophenyl)methyl]-5-nitroisoquinolin-2-ium bromide chemical structure, C17H12BrN3O2, CAS 62162-95-2
2-[(3-Cyanophenyl)methyl]-5-nitroisoquinolin-2-ium bromide
CAS 62162-95-2C17H12BrN3O2
5-Nitro-2-{[3-(trifluoromethyl)phenyl]methyl}isoquinolin-2-ium perchlorate chemical structure, C17H12ClF3N2O6, CAS 62162-94-1
5-Nitro-2-{[3-(trifluoromethyl)phenyl]methyl}isoquinolin-2-ium perchlorate
CAS 62162-94-1C17H12ClF3N2O6
2-[(3-Fluorophenyl)methyl]-5-nitroisoquinolin-2-ium bromide chemical structure, C16H12BrFN2O2, CAS 62162-92-9
2-[(3-Fluorophenyl)methyl]-5-nitroisoquinolin-2-ium bromide
CAS 62162-92-9C16H12BrFN2O2
2-Benzyl-4-hydroxyisoquinolin-2-ium chemical structure, C16H14NO+, CAS 719267-99-9
2-Benzyl-4-hydroxyisoquinolin-2-ium
CAS 719267-99-9C16H14NO+
(NZ)-N-[[2-[(4-methylphenyl)methyl]isoquinolin-2-ium-3-yl]methylidene]hydroxylamine bromide chemical structure, C18H17BrN2O, CAS 6634-49-7
(NZ)-N-[[2-[(4-methylphenyl)methyl]isoquinolin-2-ium-3-yl]methylidene]hydroxylamine bromide
CAS 6634-49-7C18H17BrN2O
[(Z)-{2-[(4-Methylphenyl)methyl]isoquinolin-3(2H)-ylidene}methyl](oxo)ammonium bromide chemical structure, C18H17BrN2O
[(Z)-{2-[(4-Methylphenyl)methyl]isoquinolin-3(2H)-ylidene}methyl](oxo)ammonium bromide
C18H17BrN2O