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Murcko scaffold

Ring system with 3 rings and 20 atoms

4 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
20
Chemicals
4
With full pages
2
Scaffold SMILES

O=C(CN1CCN(c2ccccc2)CC1)N1CCSC1

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(CN1CCN(c2ccccc2)CC1)N1CCSC1

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 4 of 4 chemicals

Dimethyl 3-{2-[4-(4-methoxyphenyl)piperazino]acetyl}-1,3-thiazolane-2,4-dicarboxylate chemical structure, C20H27N3O6S, CAS 294849-09-5
Dimethyl 3-{2-[4-(4-methoxyphenyl)piperazino]acetyl}-1,3-thiazolane-2,4-dicarboxylate
CAS 294849-09-5C20H27N3O6S
Dimethyl 3-{2-[4-(4-nitrophenyl)piperazino]acetyl}-1,3-thiazolane-2,4-dicarboxylate chemical structure, C19H24N4O7S, CAS 1007920-63-9
Dimethyl 3-{2-[4-(4-nitrophenyl)piperazino]acetyl}-1,3-thiazolane-2,4-dicarboxylate
CAS 1007920-63-9C19H24N4O7S
2,4-Dimethyl 3-{2-[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}-1,3-thiazolidine-2,4-dicarboxylate chemical structure, C19H23Cl2N3O5S, CAS 339012-82-7
2,4-Dimethyl 3-{2-[4-(3,4-dichlorophenyl)piperazin-1-yl]acetyl}-1,3-thiazolidine-2,4-dicarboxylate
CAS 339012-82-7C19H23Cl2N3O5S
Dimethyl 3-[2-(4-phenylpiperazino)acetyl]-1,3-thiazolane-2,4-dicarboxylate chemical structure, C19H25N3O5S, CAS 294849-07-3
Dimethyl 3-[2-(4-phenylpiperazino)acetyl]-1,3-thiazolane-2,4-dicarboxylate
CAS 294849-07-3C19H25N3O5S