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Murcko scaffold

Ring system with 3 rings and 24 atoms

51 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 24
Chemicals: 51
With full pages: 26

Scaffold SMILES

O=C(CSc1nnc(CNc2ccccc2)[nH]1)Nc1ccccc1

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 O=C(CSc1nnc(CNc2ccccc2)[nH]1)Nc1ccccc1

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 51 chemicals

N-(2,6-Diethylphenyl)-2-({4-ethyl-5-[(4-methoxyanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide chemical structure, C24H31N5O2S, CAS 482646-27-5

N-(2,6-Diethylphenyl)-2-({4-ethyl-5-[(4-methoxyanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

CAS 482646-27-5C₂₄H₃₁N₅O₂S

N-(4-Chlorophenyl)-2-({4-ethyl-5-[(4-methoxyanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide chemical structure, C20H22ClN5O2S, CAS 482645-57-8

N-(4-Chlorophenyl)-2-({4-ethyl-5-[(4-methoxyanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

CAS 482645-57-8C₂₀H₂₂ClN₅O₂S

2-({5-[(2,4-Dimethylanilino)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-ethyl-6-methylphenyl)acetamide chemical structure, C24H31N5OS, CAS 482645-99-8

2-({5-[(2,4-Dimethylanilino)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-ethyl-6-methylphenyl)acetamide

CAS 482645-99-8C₂₄H₃₁N₅OS

N-(5-Chloro-2-methylphenyl)-2-({5-[(2,4-dimethylanilino)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide chemical structure, C22H26ClN5OS, CAS 482646-01-5

N-(5-Chloro-2-methylphenyl)-2-({5-[(2,4-dimethylanilino)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

CAS 482646-01-5C₂₂H₂₆ClN₅OS

2-({5-[(2,4-Dimethylanilino)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-mesitylacetamide chemical structure, C24H31N5OS, CAS 482646-06-0

2-({5-[(2,4-Dimethylanilino)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-mesitylacetamide

CAS 482646-06-0C₂₄H₃₁N₅OS

Methyl 2-(2-((5-(((4-chlorophenyl)amino)methyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate chemical structure, C20H20ClN5O3S, CAS 333314-29-7

Methyl 2-(2-((5-(((4-chlorophenyl)amino)methyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate

CAS 333314-29-7C₂₀H₂₀ClN₅O₃S

2-{[4-Allyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chlorophenyl)acetamide chemical structure, C21H22ClN5OS, CAS 438468-09-8

2-{[4-Allyl-5-(4-toluidinomethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chlorophenyl)acetamide

CAS 438468-09-8C₂₁H₂₂ClN₅OS

2-[[5-[(4-Methylanilino)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)acetamide chemical structure, C22H25N5OS, CAS 438475-59-3

2-[[5-[(4-Methylanilino)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)acetamide

CAS 438475-59-3C₂₂H₂₅N₅OS

N-(2-Methoxyphenyl)-2-[[5-[(4-methylanilino)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide chemical structure, C22H25N5O2S, CAS 445287-48-9

N-(2-Methoxyphenyl)-2-[[5-[(4-methylanilino)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide

CAS 445287-48-9C₂₂H₂₅N₅O₂S

2-[[5-[(4-Methylanilino)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide chemical structure, C21H23N5OS, CAS 445287-94-5

2-[[5-[(4-Methylanilino)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide

CAS 445287-94-5C₂₁H₂₃N₅OS

2-[[5-[(4-Chloroanilino)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethoxyphenyl)acetamide chemical structure, C22H24ClN5O2S, CAS 445288-09-5

2-[[5-[(4-Chloroanilino)methyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-ethoxyphenyl)acetamide

CAS 445288-09-5C₂₂H₂₄ClN₅O₂S

N-(2,3-Dimethylphenyl)-2-({4-ethyl-5-[(4-methoxyanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide chemical structure, C22H27N5O2S, CAS 482645-60-3

N-(2,3-Dimethylphenyl)-2-({4-ethyl-5-[(4-methoxyanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

CAS 482645-60-3C₂₂H₂₇N₅O₂S

2-({4-Ethyl-5-[(4-methoxyanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-fluorophenyl)acetamide chemical structure, C20H22FN5O2S, CAS 482646-29-7

2-({4-Ethyl-5-[(4-methoxyanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-fluorophenyl)acetamide

CAS 482646-29-7C₂₀H₂₂FN₅O₂S

2-((5-(((4-Chlorophenyl)amino)methyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N-(4-iodo-2-methylphenyl)acetamide chemical structure, C19H19ClIN5OS, CAS 333314-17-3

2-((5-(((4-Chlorophenyl)amino)methyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)-N-(4-iodo-2-methylphenyl)acetamide

CAS 333314-17-3C₁₉H₁₉ClIN₅OS

2-((3-((m-Tolylamino)methyl)-1H-1,2,4-triazol-5-yl)thio)-N-(2,4,6-trichlorophenyl)acetamide chemical structure, C18H16Cl3N5OS, CAS 332128-48-0

2-((3-((m-Tolylamino)methyl)-1H-1,2,4-triazol-5-yl)thio)-N-(2,4,6-trichlorophenyl)acetamide

CAS 332128-48-0C₁₈H₁₆Cl₃N₅OS

N-(4-Chlorophenyl)-2-((3-((m-tolylamino)methyl)-1H-1,2,4-triazol-5-yl)thio)acetamide chemical structure, C18H18ClN5OS, CAS 247592-60-5

N-(4-Chlorophenyl)-2-((3-((m-tolylamino)methyl)-1H-1,2,4-triazol-5-yl)thio)acetamide

CAS 247592-60-5C₁₈H₁₈ClN₅OS

2-[(5-{[(2,6-Dimethylphenyl)amino]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-{5-nitro-2-methylphenyl}acetamide chemical structure, C21H24N6O3S, CAS 493003-81-9

2-[(5-{[(2,6-Dimethylphenyl)amino]methyl}-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-{5-nitro-2-methylphenyl}acetamide

CAS 493003-81-9C₂₁H₂₄N₆O₃S

N-(3,4-Dimethylphenyl)-2-[[3-[[(4-methylphenyl)amino]methyl]-1H-1,2,4-triazol-5-yl]thio]acetamide chemical structure, C20H23N5OS, CAS 337924-54-6

N-(3,4-Dimethylphenyl)-2-[[3-[[(4-methylphenyl)amino]methyl]-1H-1,2,4-triazol-5-yl]thio]acetamide

CAS 337924-54-6C₂₀H₂₃N₅OS

2-({5-[(3-Chloroanilino)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-ethoxyphenyl)acetamide chemical structure, C20H22ClN5O2S, CAS 338429-20-2

2-({5-[(3-Chloroanilino)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-ethoxyphenyl)acetamide

CAS 338429-20-2C₂₀H₂₂ClN₅O₂S

2-({4-Allyl-5-[(3,4-dichloroanilino)methyl]-4H-1,2,4-triazol-3-YL}sulfanyl)-N-(4-methylphenyl)acetamide chemical structure, C21H21Cl2N5OS, CAS 540498-31-5

2-({4-Allyl-5-[(3,4-dichloroanilino)methyl]-4H-1,2,4-triazol-3-YL}sulfanyl)-N-(4-methylphenyl)acetamide

CAS 540498-31-5C₂₁H₂₁Cl₂N₅OS

2-({4-Allyl-5-[(3,4-dichloroanilino)methyl]-4H-1,2,4-triazol-3-YL}sulfanyl)-N-(3-methylphenyl)acetamide chemical structure, C21H21Cl2N5OS, CAS 540498-34-8

2-({4-Allyl-5-[(3,4-dichloroanilino)methyl]-4H-1,2,4-triazol-3-YL}sulfanyl)-N-(3-methylphenyl)acetamide

CAS 540498-34-8C₂₁H₂₁Cl₂N₅OS

2-({4-Allyl-5-[(4-iodoanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,5-dichlorophenyl)acetamide chemical structure, C20H18Cl2IN5OS, CAS 445253-39-4

2-({4-Allyl-5-[(4-iodoanilino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,5-dichlorophenyl)acetamide

CAS 445253-39-4C₂₀H₁₈Cl₂IN₅OS

2-[[5-(Anilinomethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(3-chlorophenyl)propanamide chemical structure, C18H18ClN5OS, CAS 247571-53-5

2-[[5-(Anilinomethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(3-chlorophenyl)propanamide

CAS 247571-53-5C₁₈H₁₈ClN₅OS

N-(2-Chloro-4-nitrophenyl)-2-((3-((phenylamino)methyl)-1H-1,2,4-triazol-5-yl)thio)acetamide chemical structure, C17H15ClN6O3S, CAS 332357-64-9

N-(2-Chloro-4-nitrophenyl)-2-((3-((phenylamino)methyl)-1H-1,2,4-triazol-5-yl)thio)acetamide

CAS 332357-64-9C₁₇H₁₅ClN₆O₃S