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Murcko scaffold

Ring system with 2 rings and 11 atoms

26 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
11
Chemicals
26
With full pages
9
Scaffold SMILES

C1=NNC(c2ccccc2)S1

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 C1=NNC(c2ccccc2)S1

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

RefChem:381494 chemical structure, C12H13N3O2S, CAS 62236-01-5
RefChem:381494
CAS 62236-01-5C12H13N3O2S
N-{4-Acetyl-5-[4-(dimethylamino)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide chemical structure, C14H18N4O2S, CAS 62236-08-2
N-{4-Acetyl-5-[4-(dimethylamino)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide
CAS 62236-08-2C14H18N4O2S
1-(5-Amino-2-phenyl-1,3,4-thiadiazol-3(2H)-yl)ethan-1-one chemical structure, C10H11N3OS, CAS 62236-09-3
1-(5-Amino-2-phenyl-1,3,4-thiadiazol-3(2H)-yl)ethan-1-one
CAS 62236-09-3C10H11N3OS
N-[3-Acetyl-2-(3,4,5-trimethoxyphenyl)-2H-1,3,4-thiadiazol-5-yl]acetamide chemical structure, C15H19N3O5S, CAS 326903-67-7
N-[3-Acetyl-2-(3,4,5-trimethoxyphenyl)-2H-1,3,4-thiadiazol-5-yl]acetamide
CAS 326903-67-7C15H19N3O5S
[4-(5-Acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl)phenyl] acetate chemical structure, C14H15N3O4S, CAS 5840-36-8
[4-(5-Acetamido-3-acetyl-2H-1,3,4-thiadiazol-2-yl)phenyl] acetate
CAS 5840-36-8C14H15N3O4S
N-[4-Acetyl-5-(4-bromophenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide chemical structure, C12H12BrN3O2S, CAS 337501-59-4
N-[4-Acetyl-5-(4-bromophenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide
CAS 337501-59-4C12H12BrN3O2S
N-[4-Acetyl-5-(4-fluorophenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide chemical structure, C12H12FN3O2S, CAS 312597-80-1
N-[4-Acetyl-5-(4-fluorophenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide
CAS 312597-80-1C12H12FN3O2S
Ethyl [3-acetyl-5-(acetylamino)-2-phenyl-2,3-dihydro-1,3,4-thiadiazol-2-yl]acetate chemical structure, C16H19N3O4S, CAS 332389-28-3
Ethyl [3-acetyl-5-(acetylamino)-2-phenyl-2,3-dihydro-1,3,4-thiadiazol-2-yl]acetate
CAS 332389-28-3C16H19N3O4S
N-[4-Acetyl-5-methyl-5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]acetamide chemical structure, C13H14N4O4S, CAS 332389-24-9
N-[4-Acetyl-5-methyl-5-(3-nitrophenyl)-1,3,4-thiadiazol-2-yl]acetamide
CAS 332389-24-9C13H14N4O4S
Acetamide, N-(4-acetyl-4,5-dihydro-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)- chemical structure, C13H15N3O2S, CAS 72926-24-0
Acetamide, N-(4-acetyl-4,5-dihydro-5-methyl-5-phenyl-1,3,4-thiadiazol-2-yl)-
CAS 72926-24-0C13H15N3O2S
N-(4-Acetyl-5-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide chemical structure, C14H17N3O3S, CAS 150007-08-2
N-(4-Acetyl-5-(4-methoxyphenyl)-5-methyl-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
CAS 150007-08-2C14H17N3O3S
1-(5-Amino-2-methyl-2-phenyl-[1,3,4]thiadiazol-3-yl)-ethanone chemical structure, C11H13N3OS, CAS 72926-06-8
1-(5-Amino-2-methyl-2-phenyl-[1,3,4]thiadiazol-3-yl)-ethanone
CAS 72926-06-8C11H13N3OS
N-[4-Acetyl-5-(4-fluorophenyl)-5-methyl-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide chemical structure, C13H14FN3O2S, CAS 443105-73-5
N-[4-Acetyl-5-(4-fluorophenyl)-5-methyl-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide
CAS 443105-73-5C13H14FN3O2S
N-[4-Acetyl-5-(3-bromophenyl)-5-methyl-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide chemical structure, C13H14BrN3O2S, CAS 6471-33-6
N-[4-Acetyl-5-(3-bromophenyl)-5-methyl-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide
CAS 6471-33-6C13H14BrN3O2S
N-(5-Phenyl-4-pivaloyl-5-(vinylsulfonamidomethyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl)pivalamide chemical structure, C21H30N4O4S2, CAS 546111-92-6
N-(5-Phenyl-4-pivaloyl-5-(vinylsulfonamidomethyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl)pivalamide
CAS 546111-92-6C21H30N4O4S2
Litronesib racemate chemical structure, C23H37N5O4S2, CAS 546111-97-1
Litronesib racemate
CAS 546111-97-1C23H37N5O4S2
tert-Butyl ((2-phenyl-5-pivalamido-3-pivaloyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)methyl)carbamate chemical structure, C24H36N4O4S, CAS 781675-01-2
tert-Butyl ((2-phenyl-5-pivalamido-3-pivaloyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)methyl)carbamate
CAS 781675-01-2C24H36N4O4S
N-[4-Acetyl-5-(2-methylpropyl)-5-phenyl-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide chemical structure, C16H21N3O2S, CAS 355435-20-0
N-[4-Acetyl-5-(2-methylpropyl)-5-phenyl-4,5-dihydro-1,3,4-thiadiazol-2-yl]acetamide
CAS 355435-20-0C16H21N3O2S
5-tert-Butyl-2-phenyl-2,3-dihydro-1,3,4-thiadiazole chemical structure, C12H16N2S, CAS 90057-56-0
5-tert-Butyl-2-phenyl-2,3-dihydro-1,3,4-thiadiazole
CAS 90057-56-0C12H16N2S
5-Methyl-2-phenyl-2,3-dihydro-1,3,4-thiadiazole chemical structure, C9H10N2S, CAS 90057-55-9
5-Methyl-2-phenyl-2,3-dihydro-1,3,4-thiadiazole
CAS 90057-55-9C9H10N2S
Litronesib chemical structure, C23H37N5O4S2, CAS 910634-41-2
Litronesib
CAS 910634-41-2C23H37N5O4S2
(R)-tert-Butyl ((2-phenyl-5-pivalamido-3-pivaloyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)methyl)carbamate chemical structure, C24H36N4O4S, CAS 910634-47-8
(R)-tert-Butyl ((2-phenyl-5-pivalamido-3-pivaloyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)methyl)carbamate
CAS 910634-47-8C24H36N4O4S
tert-Butyl (S)-((2-phenyl-5-pivalamido-3-pivaloyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)methyl)carbamate chemical structure, C24H36N4O4S, CAS 2445094-29-9
tert-Butyl (S)-((2-phenyl-5-pivalamido-3-pivaloyl-2,3-dihydro-1,3,4-thiadiazol-2-yl)methyl)carbamate
CAS 2445094-29-9C24H36N4O4S
N-(5-(Aminomethyl)-5-phenyl-4-pivaloyl-4,5-dihydro-1,3,4-thiadiazol-2-yl)pivalamide hydrochloride chemical structure, C19H29ClN4O2S, CAS 781675-10-3
N-(5-(Aminomethyl)-5-phenyl-4-pivaloyl-4,5-dihydro-1,3,4-thiadiazol-2-yl)pivalamide hydrochloride
CAS 781675-10-3C19H29ClN4O2S