CompoundList
Sign in
Murcko scaffold

Ring system with 3 rings and 15 atoms

16 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
15
Chemicals
16
With full pages
5
Scaffold SMILES

S=c1[nH]nc(-c2csc3c2CCCC3)[nH]1

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 S=c1[nH]nc(-c2csc3c2CCCC3)[nH]1

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 16 of 16 chemicals

4-Ethyl-5-(4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol chemical structure, C12H15N3S2, CAS 438230-58-1
4-Ethyl-5-(4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol
CAS 438230-58-1C12H15N3S2
4-Allyl-5-(4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol chemical structure, C13H15N3S2, CAS 522597-46-2
4-Allyl-5-(4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol
CAS 522597-46-2C13H15N3S2
4-Isobutyl-5-(4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazol-3-yl hydrosulfide chemical structure, C14H19N3S2, CAS 438235-03-1
4-Isobutyl-5-(4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazol-3-yl hydrosulfide
CAS 438235-03-1C14H19N3S2
4-Allyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol chemical structure, C14H17N3S2, CAS 522597-60-0
4-Allyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol
CAS 522597-60-0C14H17N3S2
4-Butyl-3-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-1H-1,2,4-triazole-5-thione chemical structure, C15H21N3S2, CAS 438233-29-5
4-Butyl-3-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-1H-1,2,4-triazole-5-thione
CAS 438233-29-5C15H21N3S2
3-(6-tert-Butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione chemical structure, C18H27N3S2, CAS 438231-63-1
3-(6-tert-Butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4-(2-methylpropyl)-1H-1,2,4-triazole-5-thione
CAS 438231-63-1C18H27N3S2
2,4-Dihydro-4-methyl-5-(4,5,6,7-tetrahydrobenzo(b)thien-3-yl)-3H-1,2,4-triazole-3-thione chemical structure, C11H13N3S2, CAS 588687-36-9
2,4-Dihydro-4-methyl-5-(4,5,6,7-tetrahydrobenzo(b)thien-3-yl)-3H-1,2,4-triazole-3-thione
CAS 588687-36-9C11H13N3S2
3H-1,2,4-Triazole-3-thione, 4-butyl-5-[6-(1,1-dimethylethyl)-4,5,6,7-tetrahydrobenzo[b]thien-3-yl]-2,4-dihydro- chemical structure, C18H27N3S2, CAS 522597-49-5
3H-1,2,4-Triazole-3-thione, 4-butyl-5-[6-(1,1-dimethylethyl)-4,5,6,7-tetrahydrobenzo[b]thien-3-yl]-2,4-dihydro-
CAS 522597-49-5C18H27N3S2
4-Ethyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol chemical structure, C13H17N3S2, CAS 438231-18-6
4-Ethyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol
CAS 438231-18-6C13H17N3S2
4-Methyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol chemical structure, C12H15N3S2, CAS 588687-51-8
4-Methyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol
CAS 588687-51-8C12H15N3S2
4-(2-Methylpropyl)-3-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-1H-1,2,4-triazole-5-thione chemical structure, C15H21N3S2, CAS 438231-99-3
4-(2-Methylpropyl)-3-(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-1H-1,2,4-triazole-5-thione
CAS 438231-99-3C15H21N3S2
4-Butyl-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-1H-1,2,4-triazole-5-thione chemical structure, C14H19N3S2, CAS 438237-17-3
4-Butyl-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-1H-1,2,4-triazole-5-thione
CAS 438237-17-3C14H19N3S2
4-Propyl-5-(4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol chemical structure, C13H17N3S2, CAS 847503-21-3
4-Propyl-5-(4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol
CAS 847503-21-3C13H17N3S2
4-Isopropyl-5-(4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol chemical structure, C13H17N3S2, CAS 847503-22-4
4-Isopropyl-5-(4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol
CAS 847503-22-4C13H17N3S2
5-(6-Methyl-4,5,6,7-tetrahydro-1-benzothien-3-yl)-4-propyl-4H-1,2,4-triazole-3-thiol chemical structure, C14H19N3S2, CAS 847503-23-5
5-(6-Methyl-4,5,6,7-tetrahydro-1-benzothien-3-yl)-4-propyl-4H-1,2,4-triazole-3-thiol
CAS 847503-23-5C14H19N3S2
4-Isopropyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol chemical structure, C14H19N3S2, CAS 847503-24-6
4-Isopropyl-5-(6-methyl-4,5,6,7-tetrahydro-1-benzothien-3-yl)-4H-1,2,4-triazole-3-thiol
CAS 847503-24-6C14H19N3S2