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Murcko scaffold

Ring system with 4 rings and 20 atoms

19 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
20
Chemicals
19
With full pages
3
Scaffold SMILES

c1ccc2c(c1)Sc1ccccc1C2=C1CCNCC1

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 c1ccc2c(c1)Sc1ccccc1C2=C1CCNCC1

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 19 of 19 chemicals

Pimethixene chemical structure, C19H19NS, CAS 314-03-4
Pimethixene
CAS 314-03-4C19H19NS
Piperidine, 4-(2-chloro-9H-thioxanthen-9-ylidene)-1-methyl- chemical structure, C19H18ClNS, CAS 3973-51-1
Piperidine, 4-(2-chloro-9H-thioxanthen-9-ylidene)-1-methyl-
CAS 3973-51-1C19H18ClNS
Piperidine, 1-methyl-4-(2-(methylthio)-9H-thioxanthen-9-ylidene)- chemical structure, C20H21NS2, CAS 42754-01-8
Piperidine, 1-methyl-4-(2-(methylthio)-9H-thioxanthen-9-ylidene)-
CAS 42754-01-8C20H21NS2
Piperidine, 1-methyl-4-(2-(trifluoromethyl)-9H-thioxanthen-9-ylidene)- chemical structure, C20H18F3NS, CAS 51395-46-1
Piperidine, 1-methyl-4-(2-(trifluoromethyl)-9H-thioxanthen-9-ylidene)-
CAS 51395-46-1C20H18F3NS
Piperidine, 4-(6-fluoro-2-(methylthio)-9H-thioxanthen-9-ylidene)-1-methyl- chemical structure, C20H20FNS2, CAS 72890-88-1
Piperidine, 4-(6-fluoro-2-(methylthio)-9H-thioxanthen-9-ylidene)-1-methyl-
CAS 72890-88-1C20H20FNS2
Piperidine, 4-(6-fluoro-2-(trifluoromethyl)-9H-thioxanthen-9-ylidene)-1-methyl- chemical structure, C20H17F4NS, CAS 73846-43-2
Piperidine, 4-(6-fluoro-2-(trifluoromethyl)-9H-thioxanthen-9-ylidene)-1-methyl-
CAS 73846-43-2C20H17F4NS
Piperidine, 4-(2-chloro-6-fluoro-9H-thioxanthen-9-ylidene)-1-methyl- chemical structure, C19H17ClFNS, CAS 73846-44-3
Piperidine, 4-(2-chloro-6-fluoro-9H-thioxanthen-9-ylidene)-1-methyl-
CAS 73846-44-3C19H17ClFNS
Pimethixene maleate chemical structure, C23H23NO4S, CAS 13187-06-9
Pimethixene maleate
CAS 13187-06-9C23H23NO4S
Piperidine, 4-(6-ethoxy-1-methoxy-9H-thioxanthen-9-ylidene)-1-methyl- chemical structure, C22H25NO2S, CAS 518980-66-0
Piperidine, 4-(6-ethoxy-1-methoxy-9H-thioxanthen-9-ylidene)-1-methyl-
CAS 518980-66-0C22H25NO2S
4-(2-Chloro-9H-thioxanthen-9-ylidene)piperidine chemical structure, C18H16ClNS, CAS 42753-90-2
4-(2-Chloro-9H-thioxanthen-9-ylidene)piperidine
CAS 42753-90-2C18H16ClNS
4-(2-Bromo-9H-thioxanthen-9-ylidene)-1-methylpiperidine chemical structure, C19H18BrNS, CAS 16386-67-7
4-(2-Bromo-9H-thioxanthen-9-ylidene)-1-methylpiperidine
CAS 16386-67-7C19H18BrNS
9-(1-Methylpiperidin-4-ylidene)-9H-thioxanthene-2-carbonitrile chemical structure, C20H18N2S, CAS 62142-59-0
9-(1-Methylpiperidin-4-ylidene)-9H-thioxanthene-2-carbonitrile
CAS 62142-59-0C20H18N2S
4-(2,6-Difluoro-9H-thioxanthen-9-ylidene)-1-methylpiperidine chemical structure, C19H17F2NS, CAS 60086-14-8
4-(2,6-Difluoro-9H-thioxanthen-9-ylidene)-1-methylpiperidine
CAS 60086-14-8C19H17F2NS
9-(1-Methylpiperidin-4-ylidene)-9H-thioxanthene-2-carboxylic acid chemical structure, C20H19NO2S, CAS 65797-41-3
9-(1-Methylpiperidin-4-ylidene)-9H-thioxanthene-2-carboxylic acid
CAS 65797-41-3C20H19NO2S
4-(9H-Thioxanthen-9-ylidene)piperidine--hydrogen chloride (1/1) chemical structure, C18H18ClNS, CAS 138248-27-8
4-(9H-Thioxanthen-9-ylidene)piperidine--hydrogen chloride (1/1)
CAS 138248-27-8C18H18ClNS
1-Piperidineethanol, 4-(2-chloro-9H-thioxanthen-9-ylidene)-, ethanedioate (1:1) (salt) chemical structure, C22H22ClNO5S, CAS 94923-44-1
1-Piperidineethanol, 4-(2-chloro-9H-thioxanthen-9-ylidene)-, ethanedioate (1:1) (salt)
CAS 94923-44-1C22H22ClNO5S
1-[4-(2-Chloro-9H-thioxanthen-9-ylidene)piperidin-1-yl]butan-1-one chemical structure, C22H22ClNOS, CAS 60086-31-9
1-[4-(2-Chloro-9H-thioxanthen-9-ylidene)piperidin-1-yl]butan-1-one
CAS 60086-31-9C22H22ClNOS
1-[4-(2-Chloro-9H-thioxanthen-9-ylidene)piperidin-1-yl]ethan-1-one chemical structure, C20H18ClNOS, CAS 60086-30-8
1-[4-(2-Chloro-9H-thioxanthen-9-ylidene)piperidin-1-yl]ethan-1-one
CAS 60086-30-8C20H18ClNOS
1-[4-(9H-Thioxanthen-9-ylidene)piperidin-1-yl]propan-2-one chemical structure, C21H21NOS, CAS 42753-86-6
1-[4-(9H-Thioxanthen-9-ylidene)piperidin-1-yl]propan-2-one
CAS 42753-86-6C21H21NOS