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Murcko scaffold

Ring system with 2 rings and 13 atoms

21 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
13
Chemicals
21
With full pages
5
Scaffold SMILES

c1ccc(CSc2ccsn2)cc1

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 c1ccc(CSc2ccsn2)cc1

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 21 of 21 chemicals

4-Isothiazolecarbonitrile, 5-((cyanomethyl)thio)-3-((phenylmethyl)thio)- chemical structure, C13H9N3S3, CAS 24134-99-4
4-Isothiazolecarbonitrile, 5-((cyanomethyl)thio)-3-((phenylmethyl)thio)-
CAS 24134-99-4C13H9N3S3
3-[(2-Chlorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarbonitrile chemical structure, C12H9ClN2S2, CAS 339021-03-3
3-[(2-Chlorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarbonitrile
CAS 339021-03-3C12H9ClN2S2
3-[(4-Fluorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarbonitrile chemical structure, C12H9FN2S2, CAS 339021-11-3
3-[(4-Fluorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarbonitrile
CAS 339021-11-3C12H9FN2S2
3-[(4-Chlorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarboxamide chemical structure, C12H11ClN2OS2, CAS 303996-54-5
3-[(4-Chlorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarboxamide
CAS 303996-54-5C12H11ClN2OS2
4-Isothiazolecarbonitrile, 5-((cyanomethyl)thio)-3-(((4-fluorophenyl)methyl)thio)- chemical structure, C13H8FN3S3, CAS 135489-20-2
4-Isothiazolecarbonitrile, 5-((cyanomethyl)thio)-3-(((4-fluorophenyl)methyl)thio)-
CAS 135489-20-2C13H8FN3S3
Acetamide, 2-((4-cyano-3-((phenylmethyl)thio)-5-isothiazolyl)thio)- chemical structure, C13H11N3OS3, CAS 135489-22-4
Acetamide, 2-((4-cyano-3-((phenylmethyl)thio)-5-isothiazolyl)thio)-
CAS 135489-22-4C13H11N3OS3
Acetamide, 2-((4-cyano-3-(((4-fluorophenyl)methyl)thio)-5-isothiazolyl)thio)- chemical structure, C13H10FN3OS3, CAS 135489-23-5
Acetamide, 2-((4-cyano-3-(((4-fluorophenyl)methyl)thio)-5-isothiazolyl)thio)-
CAS 135489-23-5C13H10FN3OS3
5-Methyl-3-[(4-methylbenzyl)sulfanyl]-4-isothiazolecarbonitrile chemical structure, C13H12N2S2, CAS 338778-15-7
5-Methyl-3-[(4-methylbenzyl)sulfanyl]-4-isothiazolecarbonitrile
CAS 338778-15-7C13H12N2S2
Methyl 2-{[(4-cyano-5-methyl-3-isothiazolyl)sulfanyl]methyl}benzenecarboxylate chemical structure, C14H12N2O2S2, CAS 338778-07-7
Methyl 2-{[(4-cyano-5-methyl-3-isothiazolyl)sulfanyl]methyl}benzenecarboxylate
CAS 338778-07-7C14H12N2O2S2
3-(((2,4-Dichlorophenyl)methyl)thio)-5-methyl-4-isothiazolecarbonitrile chemical structure, C12H8Cl2N2S2, CAS 338778-63-5
3-(((2,4-Dichlorophenyl)methyl)thio)-5-methyl-4-isothiazolecarbonitrile
CAS 338778-63-5C12H8Cl2N2S2
3-[(2-Chloro-6-fluorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarbonitrile chemical structure, C12H8ClFN2S2, CAS 338778-61-3
3-[(2-Chloro-6-fluorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarbonitrile
CAS 338778-61-3C12H8ClFN2S2
3-[(3-Chlorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarbonitrile chemical structure, C12H9ClN2S2, CAS 338778-17-9
3-[(3-Chlorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarbonitrile
CAS 338778-17-9C12H9ClN2S2
3-[(2,6-Dichlorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarbonitrile chemical structure, C12H8Cl2N2S2, CAS 338778-06-6
3-[(2,6-Dichlorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarbonitrile
CAS 338778-06-6C12H8Cl2N2S2
3-[(4-Chlorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarbonitrile chemical structure, C12H9ClN2S2, CAS 338778-09-9
3-[(4-Chlorobenzyl)sulfanyl]-5-methyl-4-isothiazolecarbonitrile
CAS 338778-09-9C12H9ClN2S2
3-[(2,4-Dichlorobenzyl)sulfanyl]-5-[2-(dimethylamino)vinyl]-4-isothiazolecarbonitrile chemical structure, C15H13Cl2N3S2, CAS 338778-65-7
3-[(2,4-Dichlorobenzyl)sulfanyl]-5-[2-(dimethylamino)vinyl]-4-isothiazolecarbonitrile
CAS 338778-65-7C15H13Cl2N3S2
3-[(2-Chloro-6-fluorobenzyl)sulfanyl]-5-[2-(dimethylamino)vinyl]-4-isothiazolecarbonitrile chemical structure, C15H13ClFN3S2, CAS 338778-67-9
3-[(2-Chloro-6-fluorobenzyl)sulfanyl]-5-[2-(dimethylamino)vinyl]-4-isothiazolecarbonitrile
CAS 338778-67-9C15H13ClFN3S2
Methyl 2-[({4-cyano-5-[2-(dimethylamino)vinyl]-3-isothiazolyl}sulfanyl)methyl]benzenecarboxylate chemical structure, C17H17N3O2S2, CAS 338778-45-3
Methyl 2-[({4-cyano-5-[2-(dimethylamino)vinyl]-3-isothiazolyl}sulfanyl)methyl]benzenecarboxylate
CAS 338778-45-3C17H17N3O2S2
5-[2-(Dimethylamino)vinyl]-3-[(4-methylbenzyl)sulfanyl]-4-isothiazolecarbonitrile chemical structure, C16H17N3S2, CAS 338778-59-9
5-[2-(Dimethylamino)vinyl]-3-[(4-methylbenzyl)sulfanyl]-4-isothiazolecarbonitrile
CAS 338778-59-9C16H17N3S2
3-[(2,6-Dichlorobenzyl)sulfanyl]-5-[2-(dimethylamino)vinyl]-4-isothiazolecarbonitrile chemical structure, C15H13Cl2N3S2, CAS 338778-51-1
3-[(2,6-Dichlorobenzyl)sulfanyl]-5-[2-(dimethylamino)vinyl]-4-isothiazolecarbonitrile
CAS 338778-51-1C15H13Cl2N3S2
3-[(4-Chlorobenzyl)sulfanyl]-5-[2-(dimethylamino)vinyl]-4-isothiazolecarbonitrile chemical structure, C15H14ClN3S2, CAS 338778-57-7
3-[(4-Chlorobenzyl)sulfanyl]-5-[2-(dimethylamino)vinyl]-4-isothiazolecarbonitrile
CAS 338778-57-7C15H14ClN3S2
1-(3-{[(4-Chlorophenyl)methyl]sulfanyl}-4-cyano-1,2-thiazol-5-yl)-3-methylurea chemical structure, C13H11ClN4OS2, CAS 900525-29-3
1-(3-{[(4-Chlorophenyl)methyl]sulfanyl}-4-cyano-1,2-thiazol-5-yl)-3-methylurea
CAS 900525-29-3C13H11ClN4OS2