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Murcko scaffold

Ring system with 3 rings and 22 atoms

26 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 22
Chemicals: 26
With full pages: 5

Scaffold SMILES

O=C1Nc2ccccc2CCC1NCCCc1ccccc1

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=C1Nc2ccccc2CCC1NCCCc1ccccc1

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 26 of 26 chemicals

3-[[1-(Ethoxycarbonyl)-3-phenylpropyl]amino]-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic acid chemical structure, C24H28N2O5, CAS 98626-50-7

3-[[1-(Ethoxycarbonyl)-3-phenylpropyl]amino]-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepine-1-acetic acid

CAS 98626-50-7C₂₄H₂₈N₂O₅

2-((S)-3-((R)-1-Ethoxy-1-oxo-4-phenylbutan-2-ylamino)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)acetic acid hydrochloride chemical structure, C24H29ClN2O5, CAS 86541-77-7

2-((S)-3-((R)-1-Ethoxy-1-oxo-4-phenylbutan-2-ylamino)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-1-yl)acetic acid hydrochloride

CAS 86541-77-7C₂₄H₂₉ClN₂O₅

[(3RS)-3-[[(1SR)-1-(Ethoxycarbonyl)-3-phenylpropyl]amino]-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetic acid chemical structure, C24H28N2O5, CAS 86541-76-6

[(3RS)-3-[[(1SR)-1-(Ethoxycarbonyl)-3-phenylpropyl]amino]-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetic acid

CAS 86541-76-6C₂₄H₂₈N₂O₅

Benazepril hydrochloride chemical structure, C24H29ClN2O5, CAS 86541-74-4

Benazepril hydrochloride

CAS 86541-74-4C₂₄H₂₉ClN₂O₅

Benazepril chemical structure, C24H28N2O5, CAS 86541-75-5

CAS 86541-75-5C₂₄H₂₈N₂O₅

Benazeprilat chemical structure, C22H24N2O5, CAS 86541-78-8

CAS 86541-78-8C₂₂H₂₄N₂O₅

Benazepril-amlodipine chemical structure, C44H53ClN4O10, CAS 357437-90-2

Benazepril-amlodipine

CAS 357437-90-2C₄₄H₅₃ClN₄O₁₀

Amlodipine besylate, benazepril hydrochloride chemical structure, C50H60Cl2N4O13S, CAS 858669-53-1

Amlodipine besylate, benazepril hydrochloride

CAS 858669-53-1C₅₀H₆₀Cl₂N₄O₁₃S

(S)-Ethyl 2-(((S)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-3-yl)amino)-4-phenylbutanoate chemical structure, C22H26N2O3, CAS 367909-45-3

(S)-Ethyl 2-(((S)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-3-yl)amino)-4-phenylbutanoate

CAS 367909-45-3C₂₂H₂₆N₂O₃

Benazepril tert-Butyl Ester chemical structure, C28H36N2O5, CAS 109010-61-9

Benazepril tert-Butyl Ester

CAS 109010-61-9C₂₈H₃₆N₂O₅

1H-1-Benzazepine-1-acetic acid, 3-[[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]amino]-2,3,4,5-tetrahydro-2-oxo-, hydrochloride (1:1), (3S)-rel- chemical structure, C24H29ClN2O5, CAS 88372-38-7

1H-1-Benzazepine-1-acetic acid, 3-[[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]amino]-2,3,4,5-tetrahydro-2-oxo-, hydrochloride (1:1), (3S)-rel-

CAS 88372-38-7C₂₄H₂₉ClN₂O₅

Benazepril ethyl ester chemical structure, C26H32N2O5, CAS 103129-58-4

Benazepril ethyl ester

CAS 103129-58-4C₂₆H₃₂N₂O₅

((3RS)-3-(((1SR)-1-(Ethoxycarbonyl)-3-phenylpropyl)amino)-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)acetic-acid chemical structure, C24H28N2O5, CAS 131064-74-9

((3RS)-3-(((1SR)-1-(Ethoxycarbonyl)-3-phenylpropyl)amino)-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)acetic-acid

CAS 131064-74-9C₂₄H₂₈N₂O₅

2-((R)-3-((S)-1-Ethoxy-1-oxo-4-phenylbutan-2-ylamino)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[B]azepin-1-yl)acetic acid hydrochloride chemical structure, C24H29ClN2O5, CAS 215447-90-8

2-((R)-3-((S)-1-Ethoxy-1-oxo-4-phenylbutan-2-ylamino)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[B]azepin-1-yl)acetic acid hydrochloride

CAS 215447-90-8C₂₄H₂₉ClN₂O₅

Benazeprilat-d5 chemical structure, C22H24N2O5, CAS 1279033-05-4

Benazeprilat-d5

CAS 1279033-05-4C₂₂H₂₄N₂O₅

Ethyl (2R)-2-{[(3S)-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-3-yl]amino}-4-phenylbutanoate chemical structure, C22H26N2O3, CAS 86499-39-0

Ethyl (2R)-2-{[(3S)-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-3-yl]amino}-4-phenylbutanoate

CAS 86499-39-0C₂₂H₂₆N₂O₃

1H-1-Benzazepine-1-acetic acid, 3-((1-(ethoxycarbonyl)-3-phenylpropyl)amino)-2,3,4,5-tetrahydro-2-oxo- chemical structure, C24H28N2O5, CAS 131064-75-0

1H-1-Benzazepine-1-acetic acid, 3-((1-(ethoxycarbonyl)-3-phenylpropyl)amino)-2,3,4,5-tetrahydro-2-oxo-

CAS 131064-75-0C₂₄H₂₈N₂O₅

Benazepril hydrochloride and hydrochlorothiazide chemical structure, C31H36ClN5O9S2, CAS 151035-58-4

Benazepril hydrochloride and hydrochlorothiazide

CAS 151035-58-4C₃₁H₃₆ClN₅O₉S₂

Benazepril hydrochloride, (R,R)- chemical structure, C24H29ClN2O5, CAS 215447-89-5

Benazepril hydrochloride, (R,R)-

CAS 215447-89-5C₂₄H₂₉ClN₂O₅

Benazeprilat Ethyl tert-Butyl Diester chemical structure, C28H36N2O5, CAS 859635-53-3

Benazeprilat Ethyl tert-Butyl Diester

CAS 859635-53-3C₂₈H₃₆N₂O₅

Benazepril-d5 chemical structure, C24H28N2O5, CAS 1279200-03-1

CAS 1279200-03-1C₂₄H₂₈N₂O₅

Benazepril tert-Butyl Ester-d5 chemical structure, C28H36N2O5, CAS 1356010-96-2

Benazepril tert-Butyl Ester-d5

CAS 1356010-96-2C₂₈H₃₆N₂O₅

(2R,3'S) Benazepril tert-Butyl Ester-d5 chemical structure, C28H36N2O5, CAS 1356841-36-5

(2R,3'S) Benazepril tert-Butyl Ester-d5

CAS 1356841-36-5C₂₈H₃₆N₂O₅

Ethyl (2S)-2-deuterio-2-[deuterio-[(3S)-3-deuterio-1-[1,1-dideuterio-2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-2-oxo-4,5-dihydro-1-benzazepin-3-yl]amino]-4-phenylbutanoate chemical structure, C28H36N2O5

Ethyl (2S)-2-deuterio-2-[deuterio-[(3S)-3-deuterio-1-[1,1-dideuterio-2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-2-oxo-4,5-dihydro-1-benzazepin-3-yl]amino]-4-phenylbutanoate

C₂₈H₃₆N₂O₅