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Murcko scaffold

Ring system with 3 rings and 26 atoms

460 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 26
Chemicals: 460
With full pages: 3

Scaffold SMILES

O=C(CSc1nnc(CNC(=O)c2ccccc2)[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(CNC(=O)c2ccccc2)[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 460 chemicals

2-Fluoro-N-[[4-methyl-5-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C22H24FN5O2S, CAS 667898-39-7

2-Fluoro-N-[[4-methyl-5-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 667898-39-7C₂₂H₂₄FN₅O₂S

2-Fluoro-N-[[5-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C21H22FN5O3S, CAS 694505-52-7

2-Fluoro-N-[[5-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 694505-52-7C₂₁H₂₂FN₅O₃S

2,4-Dichloro-N-[[5-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C21H21Cl2N5O3S, CAS 694507-80-7

2,4-Dichloro-N-[[5-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 694507-80-7C₂₁H₂₁Cl₂N₅O₃S

N-[[4-Ethyl-5-[2-(3-methylsulfanylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-methylbenzamide chemical structure, C22H25N5O2S2, CAS 665018-26-8

N-[[4-Ethyl-5-[2-(3-methylsulfanylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-methylbenzamide

CAS 665018-26-8C₂₂H₂₅N₅O₂S₂

N-[[4-Ethyl-5-[2-(3-methylsulfanylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide chemical structure, C22H25N5O3S2, CAS 694468-61-6

N-[[4-Ethyl-5-[2-(3-methylsulfanylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide

CAS 694468-61-6C₂₂H₂₅N₅O₃S₂

4-Chloro-N-[[4-ethyl-5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C20H19ClFN5O2S, CAS 694460-90-7

4-Chloro-N-[[4-ethyl-5-[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 694460-90-7C₂₀H₁₉ClFN₅O₂S

3,4-Dimethoxy-N-[[5-[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C22H25N5O5S, CAS 723297-40-3

3,4-Dimethoxy-N-[[5-[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 723297-40-3C₂₂H₂₅N₅O₅S

2-Chloro-N-[[5-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C21H22ClN5O3S, CAS 694467-59-9

2-Chloro-N-[[5-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 694467-59-9C₂₁H₂₂ClN₅O₃S

2-Bromo-N-[[5-[2-(5-fluoro-2-methylanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C22H21BrFN5O2S, CAS 718600-30-7

2-Bromo-N-[[5-[2-(5-fluoro-2-methylanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 718600-30-7C₂₂H₂₁BrFN₅O₂S

N-[[5-[2-(3-Bromoanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-3-methylbenzamide chemical structure, C21H22BrN5O2S, CAS 713491-44-2

N-[[5-[2-(3-Bromoanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-3-methylbenzamide

CAS 713491-44-2C₂₁H₂₂BrN₅O₂S

N-[[5-[2-(3-Bromoanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-2-fluorobenzamide chemical structure, C19H17BrFN5O2S, CAS 713492-43-4

N-[[5-[2-(3-Bromoanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-2-fluorobenzamide

CAS 713492-43-4C₁₉H₁₇BrFN₅O₂S

2-Chloro-N-[[5-[2-(2-chloroanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C20H19Cl2N5O2S, CAS 694456-04-7

2-Chloro-N-[[5-[2-(2-chloroanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 694456-04-7C₂₀H₁₉Cl₂N₅O₂S

4-Chloro-N-[[4-ethyl-5-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C23H26ClN5O2S, CAS 694456-57-0

4-Chloro-N-[[4-ethyl-5-[2-(2-ethyl-6-methylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 694456-57-0C₂₃H₂₆ClN₅O₂S

2-Chloro-N-[[5-[2-(5-chloro-2-methylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C20H19Cl2N5O2S, CAS 694456-69-4

2-Chloro-N-[[5-[2-(5-chloro-2-methylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 694456-69-4C₂₀H₁₉Cl₂N₅O₂S

N-[[5-[2-(4-Bromo-2,3-dimethylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-3-methylbenzamide chemical structure, C22H24BrN5O2S, CAS 694456-72-9

N-[[5-[2-(4-Bromo-2,3-dimethylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-3-methylbenzamide

CAS 694456-72-9C₂₂H₂₄BrN₅O₂S

4-Chloro-N-[[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C21H18Cl2F3N5O2S, CAS 694461-38-6

4-Chloro-N-[[5-[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 694461-38-6C₂₁H₁₈Cl₂F₃N₅O₂S

4-Chloro-N-[[4-methyl-5-[2-(3-methylsulfanylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C20H20ClN5O2S2, CAS 694461-82-0

4-Chloro-N-[[4-methyl-5-[2-(3-methylsulfanylanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 694461-82-0C₂₀H₂₀ClN₅O₂S₂

N-[[5-[2-(4-Bromo-2-fluoroanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide chemical structure, C21H21BrFN5O3S, CAS 694462-24-3

N-[[5-[2-(4-Bromo-2-fluoroanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide

CAS 694462-24-3C₂₁H₂₁BrFN₅O₃S

4-Chloro-N-[[4-ethyl-5-[2-oxo-2-(2,4,6-trichloroanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C20H17Cl4N5O2S, CAS 713097-25-7

4-Chloro-N-[[4-ethyl-5-[2-oxo-2-(2,4,6-trichloroanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 713097-25-7C₂₀H₁₇Cl₄N₅O₂S

N-[[5-[2-(4-Bromo-2,3-dimethylanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-chlorobenzamide chemical structure, C22H23BrClN5O2S, CAS 713097-33-7

N-[[5-[2-(4-Bromo-2,3-dimethylanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-chlorobenzamide

CAS 713097-33-7C₂₂H₂₃BrClN₅O₂S

Ethyl 4-[({[5-({[(2-chlorophenyl)carbonyl]amino}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate chemical structure, C22H22ClN5O4S, CAS 713097-39-3

Ethyl 4-[({[5-({[(2-chlorophenyl)carbonyl]amino}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate

CAS 713097-39-3C₂₂H₂₂ClN₅O₄S

N-[[5-[2-(2-Bromo-4,5-dimethylanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-methylbenzamide chemical structure, C23H26BrN5O2S, CAS 713097-48-4

N-[[5-[2-(2-Bromo-4,5-dimethylanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-4-methylbenzamide

CAS 713097-48-4C₂₃H₂₆BrN₅O₂S

N-[[5-[2-(4-Bromo-2,6-dimethylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-4-methylbenzamide chemical structure, C22H24BrN5O2S, CAS 713097-92-8

N-[[5-[2-(4-Bromo-2,6-dimethylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-4-methylbenzamide

CAS 713097-92-8C₂₂H₂₄BrN₅O₂S

3-Chloro-N-[[4-methyl-5-[2-oxo-2-(2,4,5-trichloroanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C19H15Cl4N5O2S, CAS 694505-85-6

3-Chloro-N-[[4-methyl-5-[2-oxo-2-(2,4,5-trichloroanilino)ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

CAS 694505-85-6C₁₉H₁₅Cl₄N₅O₂S