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Murcko scaffold

Ring system with 4 rings and 21 atoms

18 chemicals on CompoundList share this ring system.

Rings: 4
Scaffold atoms: 21
Chemicals: 18
With full pages: 5

Scaffold SMILES

O=C1CCCC2=C1C(c1ccco1)Nc1ccccc1N2

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=C1CCCC2=C1C(c1ccco1)Nc1ccccc1N2

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 18 of 18 chemicals

10-Acetyl-11-(2-furyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,E][1,4]diazepin-1-one chemical structure, C21H22N2O3, CAS 418804-32-7

10-Acetyl-11-(2-furyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,E][1,4]diazepin-1-one

CAS 418804-32-7C₂₁H₂₂N₂O₃

11-(2-Furyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one chemical structure, C19H20N2O2, CAS 145628-72-4

11-(2-Furyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

CAS 145628-72-4C₁₉H₂₀N₂O₂

9,9-Dimethyl-6-(5-nitrofuran-2-yl)-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one chemical structure, C19H19N3O4, CAS 372508-69-5

9,9-Dimethyl-6-(5-nitrofuran-2-yl)-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one

CAS 372508-69-5C₁₉H₁₉N₃O₄

9,9-Dimethyl-6-(5-methylfuran-2-yl)-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one chemical structure, C20H22N2O2, CAS 332898-10-9

9,9-Dimethyl-6-(5-methylfuran-2-yl)-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one

CAS 332898-10-9C₂₀H₂₂N₂O₂

6-(Furan-2-yl)-3,9,9-trimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one chemical structure, C20H22N2O2, CAS 312621-54-8

6-(Furan-2-yl)-3,9,9-trimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one

CAS 312621-54-8C₂₀H₂₂N₂O₂

5-Acetyl-9,9-dimethyl-6-(5-nitrofuran-2-yl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one chemical structure, C21H21N3O5, CAS 423728-88-5

5-Acetyl-9,9-dimethyl-6-(5-nitrofuran-2-yl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one

CAS 423728-88-5C₂₁H₂₁N₃O₅

6-(Furan-2-yl)-9,9-dimethyl-5-(3-methylbutanoyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one chemical structure, C24H28N2O3, CAS 337502-78-0

6-(Furan-2-yl)-9,9-dimethyl-5-(3-methylbutanoyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one

CAS 337502-78-0C₂₄H₂₈N₂O₃

5-Acetyl-6-(furan-2-yl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one chemical structure, C19H18N2O3, CAS 403714-14-7

5-Acetyl-6-(furan-2-yl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one

CAS 403714-14-7C₁₉H₁₈N₂O₃

6-(Furan-2-yl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one chemical structure, C21H24N2O2, CAS 915892-56-7

6-(Furan-2-yl)-2,3,9,9-tetramethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one

CAS 915892-56-7C₂₁H₂₄N₂O₂

11-(2-Furyl)-3-methyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one chemical structure, C18H18N2O2, CAS 726200-23-3

11-(2-Furyl)-3-methyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

CAS 726200-23-3C₁₈H₁₈N₂O₂

11-(Furan-2-yl)-3-methyl-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one chemical structure, C21H22N2O3, CAS 726200-24-4

11-(Furan-2-yl)-3-methyl-10-propanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

CAS 726200-24-4C₂₁H₂₂N₂O₃

(11-Furan-2-yl-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-dibenzo[b,e][1,4]diazep chemical structure, C22H24N2O4, CAS 433248-02-3

(11-Furan-2-yl-3,3-dimethyl-1-oxo-1,2,3,4,5,11-hexahydro-dibenzo[b,e][1,4]diazep

CAS 433248-02-3C₂₂H₂₄N₂O₄

11-(2-Furyl)-10-isobutyryl-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one chemical structure, C23H26N2O3, CAS 419551-51-2

11-(2-Furyl)-10-isobutyryl-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

CAS 419551-51-2C₂₃H₂₆N₂O₃

6-(2-Furyl)-9,9-dimethyl-5-(2,2,2-trifluoroacetyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one chemical structure, C21H19F3N2O3, CAS 328262-02-8

6-(2-Furyl)-9,9-dimethyl-5-(2,2,2-trifluoroacetyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one

CAS 328262-02-8C₂₁H₁₉F₃N₂O₃

$6-Chloro-10-(furan-2-yl)-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6-tetraen-12-one chemical structure, C19H19ClN2O2, CAS 1020252-51-0$

6-Chloro-10-(furan-2-yl)-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6-tetraen-12-one

CAS 1020252-51-0C₁₉H₁₉ClN₂O₂

11-(Furan-2-yl)-10-(hydroxyacetyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one chemical structure, C21H22N2O4, CAS 896665-61-5

11-(Furan-2-yl)-10-(hydroxyacetyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

CAS 896665-61-5C₂₁H₂₂N₂O₄

Ethyl 2-(11-(furan-2-yl)-3,3-dimethyl-1-oxo-3,4-dihydro-1H-dibenzo[b,e][1,4]diazepin-10(2H,5H,11H)-yl)acetate chemical structure, C23H26N2O4, CAS 895362-34-2

Ethyl 2-(11-(furan-2-yl)-3,3-dimethyl-1-oxo-3,4-dihydro-1H-dibenzo[b,e][1,4]diazepin-10(2H,5H,11H)-yl)acetate

CAS 895362-34-2C₂₃H₂₆N₂O₄

11-(2-Furyl)-3,3-dimethyl-10-propionyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one chemical structure, C22H24N2O3, CAS 895362-35-3

11-(2-Furyl)-3,3-dimethyl-10-propionyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

CAS 895362-35-3C₂₂H₂₄N₂O₃