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Murcko scaffold

Ring system with 3 rings and 19 atoms

62 chemicals on CompoundList share this ring system.

Rings: 3
Scaffold atoms: 19
Chemicals: 62
With full pages: 19

Scaffold SMILES

O=S(=O)(c1ccccc1)N1CCOc2ccccc21

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=S(=O)(c1ccccc1)N1CCOc2ccccc21

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 62 chemicals

4-(2,3-Dihydro-4H-1,4-benzoxazin-4-ylsulfonyl)phenyl methyl ether chemical structure, C15H15NO4S, CAS 861211-09-8

4-(2,3-Dihydro-4H-1,4-benzoxazin-4-ylsulfonyl)phenyl methyl ether

CAS 861211-09-8C₁₅H₁₅NO₄S

6-Chloro-4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid chemical structure, C16H14ClNO6S, CAS 866134-61-4

6-Chloro-4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid

CAS 866134-61-4C₁₆H₁₄ClNO₆S

3-Methyl-4-(phenylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine chemical structure, C15H15NO3S, CAS 478031-97-9

3-Methyl-4-(phenylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine

CAS 478031-97-9C₁₅H₁₅NO₃S

Ethyl 4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate chemical structure, C18H19NO6S, CAS 866041-06-7

Ethyl 4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate

CAS 866041-06-7C₁₈H₁₉NO₆S

4-[(4-Chlorophenyl)sulfonyl]-3-methyl-3,4-dihydro-2H-1,4-benzoxazine chemical structure, C15H14ClNO3S, CAS 338747-51-6

4-[(4-Chlorophenyl)sulfonyl]-3-methyl-3,4-dihydro-2H-1,4-benzoxazine

CAS 338747-51-6C₁₅H₁₄ClNO₃S

6-(Ethylsulfonyl)-4-[(4-methylphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid chemical structure, C18H19NO7S2, CAS 866051-08-3

6-(Ethylsulfonyl)-4-[(4-methylphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid

CAS 866051-08-3C₁₈H₁₉NO₇S₂

Ethyl 6-(2-methoxy-2-oxoethyl)-4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate chemical structure, C21H23NO8S, CAS 866134-49-8

Ethyl 6-(2-methoxy-2-oxoethyl)-4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate

CAS 866134-49-8C₂₁H₂₃NO₈S

3-(tert-Butyl)-4-[(4-methoxyphenyl)sulfonyl]-6-methyl-3,4-dihydro-2H-1,4-benzoxazine chemical structure, C20H25NO4S, CAS 478048-82-7

3-(tert-Butyl)-4-[(4-methoxyphenyl)sulfonyl]-6-methyl-3,4-dihydro-2H-1,4-benzoxazine

CAS 478048-82-7C₂₀H₂₅NO₄S

Ethyl 6-chloro-4-{[3-(trifluoromethyl)phenyl]sulfonyl}-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate chemical structure, C18H15ClF3NO5S, CAS 866134-62-5

Ethyl 6-chloro-4-{[3-(trifluoromethyl)phenyl]sulfonyl}-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate

CAS 866134-62-5C₁₈H₁₅ClF₃NO₅S

6-(Ethylsulfonyl)-4-(phenylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid chemical structure, C17H17NO7S2, CAS 866051-05-0

6-(Ethylsulfonyl)-4-(phenylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid

CAS 866051-05-0C₁₇H₁₇NO₇S₂

4-[(4-Chlorophenyl)sulfonyl]-6-(ethylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid chemical structure, C17H16ClNO7S2, CAS 866051-02-7

4-[(4-Chlorophenyl)sulfonyl]-6-(ethylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid

CAS 866051-02-7C₁₇H₁₆ClNO₇S₂

Ethyl 6-(ethylsulfonyl)-4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate chemical structure, C20H23NO8S2, CAS 866050-91-1

Ethyl 6-(ethylsulfonyl)-4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate

CAS 866050-91-1C₂₀H₂₃NO₈S₂

4-[(4-Methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid chemical structure, C16H15NO6S, CAS 866041-07-8

4-[(4-Methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid

CAS 866041-07-8C₁₆H₁₅NO₆S

3-(tert-Butyl)-4-[(4-methylphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine chemical structure, C19H23NO3S, CAS 478043-16-2

3-(tert-Butyl)-4-[(4-methylphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine

CAS 478043-16-2C₁₉H₂₃NO₃S

6-(Ethylsulfonyl)-4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid chemical structure, C18H19NO8S2, CAS 866050-98-8

6-(Ethylsulfonyl)-4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid

CAS 866050-98-8C₁₈H₁₉NO₈S₂

Methyl 2-{4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-yl}acetate chemical structure, C18H19NO6S, CAS 439107-36-5

Methyl 2-{4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-yl}acetate

CAS 439107-36-5C₁₈H₁₉NO₆S

Ethyl 4-{[4-(tert-butyl)phenyl]sulfonyl}-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate chemical structure, C21H24ClNO5S, CAS 866134-64-7

Ethyl 4-{[4-(tert-butyl)phenyl]sulfonyl}-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate

CAS 866134-64-7C₂₁H₂₄ClNO₅S

6-Chloro-4-[(4-chlorophenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid chemical structure, C15H11Cl2NO5S, CAS 866134-68-1

6-Chloro-4-[(4-chlorophenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid

CAS 866134-68-1C₁₅H₁₁Cl₂NO₅S

6-(Carboxymethyl)-4-{[3-(trifluoromethyl)phenyl]sulfonyl}-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid chemical structure, C18H14F3NO7S, CAS 866134-99-8

6-(Carboxymethyl)-4-{[3-(trifluoromethyl)phenyl]sulfonyl}-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid

CAS 866134-99-8C₁₈H₁₄F₃NO₇S

Ethyl 4-[(4-chlorophenyl)sulfonyl]-6-(ethylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate chemical structure, C19H20ClNO7S2, CAS 866051-00-5

Ethyl 4-[(4-chlorophenyl)sulfonyl]-6-(ethylsulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate

CAS 866051-00-5C₁₉H₂₀ClNO₇S₂

Ethyl 6-chloro-4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate chemical structure, C18H18ClNO6S, CAS 866134-51-2

Ethyl 6-chloro-4-[(4-methoxyphenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate

CAS 866134-51-2C₁₈H₁₈ClNO₆S

6-Chloro-4-{[3-(trifluoromethyl)phenyl]sulfonyl}-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid chemical structure, C16H11ClF3NO5S, CAS 866134-76-1

6-Chloro-4-{[3-(trifluoromethyl)phenyl]sulfonyl}-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid

CAS 866134-76-1C₁₆H₁₁ClF₃NO₅S

2-{4-[(4-Bromophenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-yl}acetic acid chemical structure, C16H14BrNO5S, CAS 865657-67-6

2-{4-[(4-Bromophenyl)sulfonyl]-3,4-dihydro-2H-1,4-benzoxazin-3-yl}acetic acid

CAS 865657-67-6C₁₆H₁₄BrNO₅S

4-{[4-(tert-Butyl)phenyl]sulfonyl}-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid chemical structure, C19H20ClNO5S, CAS 866134-75-0

4-{[4-(tert-Butyl)phenyl]sulfonyl}-6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylic acid

CAS 866134-75-0C₁₉H₂₀ClNO₅S