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Murcko scaffold

Ring system with 3 rings and 26 atoms

70 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 26
Chemicals: 70
With full pages: 3

Scaffold SMILES

O=C(Cc1cscn1)Nc1ccc(CCNCCc2ccccc2)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 scaffold

Murcko scaffold O=C(Cc1cscn1)Nc1ccc(CCNCCc2ccccc2)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 48 of 70 chemicals

Mirabegron chemical structure, C21H24N4O2S, CAS 223673-61-8

CAS 223673-61-8C₂₁H₂₄N₄O₂S

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-(3-cyanophenyl)-2-hydroxyethyl)amino)ethyl)phenyl)acetamide chemical structure, C22H23N5O2S, CAS 359794-39-1

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-(3-cyanophenyl)-2-hydroxyethyl)amino)ethyl)phenyl)acetamide

CAS 359794-39-1C₂₂H₂₃N₅O₂S

N-(4-(2-((2-Hydroxy-2-phenylethyl)amino)ethyl)phenyl)-2-(2-imino-2,3-dihydro-1,3-thiazol-4-yl)acetamide chemical structure, C21H24N4O2S, CAS 928324-05-4

N-(4-(2-((2-Hydroxy-2-phenylethyl)amino)ethyl)phenyl)-2-(2-imino-2,3-dihydro-1,3-thiazol-4-yl)acetamide

CAS 928324-05-4C₂₁H₂₄N₄O₂S

(R)-2-(2-Amino-5-methylthiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide chemical structure, C22H26N4O2S, CAS 781599-71-1

(R)-2-(2-Amino-5-methylthiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide

CAS 781599-71-1C₂₂H₂₆N₄O₂S

rac Mirabegron-d5 chemical structure, C21H24N4O2S, CAS 1215807-38-7

rac Mirabegron-d5

CAS 1215807-38-7C₂₁H₂₄N₄O₂S

N-tert-Butoxycarbonyl Mirabegron chemical structure, C26H32N4O4S, CAS 1329485-55-3

N-tert-Butoxycarbonyl Mirabegron

CAS 1329485-55-3C₂₆H₃₂N₄O₄S

(S)-Mirabegron chemical structure, C21H24N4O2S, CAS 1796931-48-0

CAS 1796931-48-0C₂₁H₂₄N₄O₂S

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide hydrochloride chemical structure, C21H25ClN4O2S, CAS 1623743-60-1

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide hydrochloride

CAS 1623743-60-1C₂₁H₂₅ClN₄O₂S

(R)-2-(2-Guanidinothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide chemical structure, C22H26N6O2S, CAS 780023-47-4

(R)-2-(2-Guanidinothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide

CAS 780023-47-4C₂₂H₂₆N₆O₂S

(R)-2-(2-Acetamidothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide chemical structure, C23H26N4O3S, CAS 765885-03-8

(R)-2-(2-Acetamidothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide

CAS 765885-03-8C₂₃H₂₆N₄O₃S

2-(2-Amino-1,3-thiazol-4-yl)-N-[4-(2-{[2-phenylethyl]amino}ethyl)phenyl]acetamide chemical structure, C21H24N4OS, CAS 1581284-82-3

2-(2-Amino-1,3-thiazol-4-yl)-N-[4-(2-{[2-phenylethyl]amino}ethyl)phenyl]acetamide

CAS 1581284-82-3C₂₁H₂₄N₄OS

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide compound with (methylsulfinyl)methane (1:1) chemical structure, C23H30N4O3S2, CAS 1671885-38-3

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide compound with (methylsulfinyl)methane (1:1)

CAS 1671885-38-3C₂₃H₃₀N₄O₃S₂

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)(4-hydroxybutyl)amino)ethyl)phenyl)acetamide chemical structure, C25H32N4O3S, CAS 1684452-97-8

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)(4-hydroxybutyl)amino)ethyl)phenyl)acetamide

CAS 1684452-97-8C₂₅H₃₂N₄O₃S

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide acetate chemical structure, C23H28N4O4S, CAS 1685269-29-7

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide acetate

CAS 1685269-29-7C₂₃H₂₈N₄O₄S

(R)-2-((4-(2-(2-Aminothiazol-4-yl)acetamido)phenethyl)amino)-1-phenylethyl acetate chemical structure, C23H26N4O3S, CAS 2490480-32-3

(R)-2-((4-(2-(2-Aminothiazol-4-yl)acetamido)phenethyl)amino)-1-phenylethyl acetate

CAS 2490480-32-3C₂₃H₂₆N₄O₃S

2-(2-Formamidothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide chemical structure, C22H24N4O3S, CAS 2985749-48-0

2-(2-Formamidothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide

CAS 2985749-48-0C₂₂H₂₄N₄O₃S

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-(N-(2-hydroxy-2-phenylethyl)acetamido)ethyl)phenyl)acetamide chemical structure, C23H26N4O3S, CAS 2882917-41-9

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-(N-(2-hydroxy-2-phenylethyl)acetamido)ethyl)phenyl)acetamide

CAS 2882917-41-9C₂₃H₂₆N₄O₃S

2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-(2-hydroxyphenyl)ethyl)amino)ethyl)phenyl)acetamide chemical structure, C21H24N4O3S, CAS 211636-16-7

2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-(2-hydroxyphenyl)ethyl)amino)ethyl)phenyl)acetamide

CAS 211636-16-7C₂₁H₂₄N₄O₃S

(R)-2-((4-(2-(2-Aminothiazol-4-yl)acetamido)phenethyl)amino)-1-phenylethyl isobutyrate chemical structure, C25H30N4O3S, CAS 2490480-34-5

(R)-2-((4-(2-(2-Aminothiazol-4-yl)acetamido)phenethyl)amino)-1-phenylethyl isobutyrate

CAS 2490480-34-5C₂₅H₃₀N₄O₃S

(R)-2-((4-(2-(2-Aminothiazol-4-yl)acetamido)phenethyl)amino)-1-phenylethyl 2-hydroxypropanoate chemical structure, C24H28N4O4S, CAS 2490480-42-5

(R)-2-((4-(2-(2-Aminothiazol-4-yl)acetamido)phenethyl)amino)-1-phenylethyl 2-hydroxypropanoate

CAS 2490480-42-5C₂₄H₂₈N₄O₄S

(R)-2-((4-(2-(2-Aminothiazol-4-yl)acetamido)phenethyl)amino)-1-phenylethyl pivalate chemical structure, C26H32N4O3S, CAS 2242471-30-1

(R)-2-((4-(2-(2-Aminothiazol-4-yl)acetamido)phenethyl)amino)-1-phenylethyl pivalate

CAS 2242471-30-1C₂₆H₃₂N₄O₃S

(R)-4-(2-((4-(2-(2-Aminothiazol-4-yl)acetamido)phenethyl)amino)-1-phenylethoxy)-4-oxobutanoic acid chemical structure, C25H28N4O5S, CAS 2490480-36-7

(R)-4-(2-((4-(2-(2-Aminothiazol-4-yl)acetamido)phenethyl)amino)-1-phenylethoxy)-4-oxobutanoic acid

CAS 2490480-36-7C₂₅H₂₈N₄O₅S

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide succinate chemical structure, C25H30N4O6S, CAS 1897370-95-4

(R)-2-(2-Aminothiazol-4-yl)-N-(4-(2-((2-hydroxy-2-phenylethyl)amino)ethyl)phenyl)acetamide succinate

CAS 1897370-95-4C₂₅H₃₀N₄O₆S

Dehydroxy mirabegron hydrochloride salt chemical structure, C21H25ClN4OS, CAS 1581284-79-8

Dehydroxy mirabegron hydrochloride salt

CAS 1581284-79-8C₂₁H₂₅ClN₄OS