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Murcko scaffold

Ring system with 3 rings and 26 atoms

22 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
26
Chemicals
22
With full pages
2
Scaffold SMILES

O=C(CSc1nnc(NC(=O)c2ccccc2)s1)NCc1ccccc1

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(CSc1nnc(NC(=O)c2ccccc2)s1)NCc1ccccc1

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 22 of 22 chemicals

N-[5-[2-(Benzylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-methylbenzamide chemical structure, C19H18N4O2S2, CAS 604747-26-4
N-[5-[2-(Benzylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-4-methylbenzamide
CAS 604747-26-4C19H18N4O2S2
N-[5-[2-(Benzylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methoxybenzamide chemical structure, C19H18N4O3S2, CAS 868973-29-9
N-[5-[2-(Benzylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-methoxybenzamide
CAS 868973-29-9C19H18N4O3S2
N-[5-[2-(Benzylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-methoxybenzamide chemical structure, C19H18N4O3S2, CAS 868974-69-0
N-[5-[2-(Benzylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-methoxybenzamide
CAS 868974-69-0C19H18N4O3S2
N-(5-((2-((2-Chlorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2,4-dimethoxybenzamide chemical structure, C20H19ClN4O4S2, CAS 896022-00-7
N-(5-((2-((2-Chlorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2,4-dimethoxybenzamide
CAS 896022-00-7C20H19ClN4O4S2
N-(5-((2-((4-Fluorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3-(trifluoromethyl)benzamide chemical structure, C19H14F4N4O2S2, CAS 868973-49-3
N-(5-((2-((4-Fluorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3-(trifluoromethyl)benzamide
CAS 868973-49-3C19H14F4N4O2S2
2-Fluoro-N-[5-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide chemical structure, C18H14F2N4O2S2, CAS 896022-88-1
2-Fluoro-N-[5-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
CAS 896022-88-1C18H14F2N4O2S2
N-(5-((2-((2-Chlorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3-fluorobenzamide chemical structure, C18H14ClFN4O2S2, CAS 868973-85-7
N-(5-((2-((2-Chlorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3-fluorobenzamide
CAS 868973-85-7C18H14ClFN4O2S2
N-(5-((2-(Benzylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3-chlorobenzamide chemical structure, C18H15ClN4O2S2, CAS 896023-58-8
N-(5-((2-(Benzylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3-chlorobenzamide
CAS 896023-58-8C18H15ClN4O2S2
N-(5-((2-(Benzylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-4-ethoxybenzamide chemical structure, C20H20N4O3S2, CAS 868974-10-1
N-(5-((2-(Benzylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-4-ethoxybenzamide
CAS 868974-10-1C20H20N4O3S2
3-Bromo-N-(5-((2-((4-fluorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide chemical structure, C18H14BrFN4O2S2, CAS 868974-53-2
3-Bromo-N-(5-((2-((4-fluorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide
CAS 868974-53-2C18H14BrFN4O2S2
4-Butoxy-N-(5-((2-((4-fluorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide chemical structure, C22H23FN4O3S2, CAS 896026-72-5
4-Butoxy-N-(5-((2-((4-fluorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide
CAS 896026-72-5C22H23FN4O3S2
N-(5-((2-((4-Fluorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)benzamide chemical structure, C19H14F4N4O2S2, CAS 868976-07-2
N-(5-((2-((4-Fluorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)benzamide
CAS 868976-07-2C19H14F4N4O2S2
2,5-Dichloro-N-(5-((2-((4-fluorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide chemical structure, C18H13Cl2FN4O2S2, CAS 868976-62-9
2,5-Dichloro-N-(5-((2-((4-fluorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide
CAS 868976-62-9C18H13Cl2FN4O2S2
2,5-Dichloro-N-(5-((2-((2-chlorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide chemical structure, C18H13Cl3N4O2S2, CAS 896031-34-8
2,5-Dichloro-N-(5-((2-((2-chlorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide
CAS 896031-34-8C18H13Cl3N4O2S2
N-(5-((2-(Benzylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-4-(N,N-dimethylsulfamoyl)benzamide chemical structure, C20H21N5O4S3, CAS 868976-94-7
N-(5-((2-(Benzylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-4-(N,N-dimethylsulfamoyl)benzamide
CAS 868976-94-7C20H21N5O4S3
N-(5-((2-((2-Chlorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-4-(N,N-dimethylsulfamoyl)benzamide chemical structure, C20H20ClN5O4S3, CAS 896032-06-7
N-(5-((2-((2-Chlorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-4-(N,N-dimethylsulfamoyl)benzamide
CAS 896032-06-7C20H20ClN5O4S3
3,4-Diethoxy-N-(5-((2-((4-fluorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide chemical structure, C22H23FN4O4S2, CAS 896033-14-0
3,4-Diethoxy-N-(5-((2-((4-fluorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide
CAS 896033-14-0C22H23FN4O4S2
N-(5-((2-((2-Chlorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3,4-diethoxybenzamide chemical structure, C22H23ClN4O4S2, CAS 896033-34-4
N-(5-((2-((2-Chlorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3,4-diethoxybenzamide
CAS 896033-34-4C22H23ClN4O4S2
2,6-Difluoro-N-{5-[({[(4-fluorophenyl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide chemical structure, C18H13F3N4O2S2, CAS 920433-15-4
2,6-Difluoro-N-{5-[({[(4-fluorophenyl)methyl]carbamoyl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}benzamide
CAS 920433-15-4C18H13F3N4O2S2
N-(5-((2-(Benzylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3,4,5-triethoxybenzamide chemical structure, C24H28N4O5S2, CAS 921093-71-2
N-(5-((2-(Benzylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3,4,5-triethoxybenzamide
CAS 921093-71-2C24H28N4O5S2
N-(5-((2-(Benzylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3,5-dimethoxybenzamide chemical structure, C20H20N4O4S2, CAS 893345-58-9
N-(5-((2-(Benzylamino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3,5-dimethoxybenzamide
CAS 893345-58-9C20H20N4O4S2
N-(5-((2-((2-Chlorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3-(trifluoromethyl)benzamide chemical structure, C19H14ClF3N4O2S2, CAS 920449-67-8
N-(5-((2-((2-Chlorobenzyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3-(trifluoromethyl)benzamide
CAS 920449-67-8C19H14ClF3N4O2S2