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Murcko scaffold

Ring system with 3 rings and 15 atoms

12 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
15
Chemicals
12
With full pages
3
Scaffold SMILES

C=C1c2ccccc2CSc2sccc21

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 C=C1c2ccccc2CSc2sccc21

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 12 of 12 chemicals

1-Propanamine, N,N-dimethyl-3-(thieno(2,3-c)(2)benzothiepin-4(9H)-ylidene)-, hydrochloride (1:1) chemical structure, C17H20ClNS2, CAS 1154-12-7
1-Propanamine, N,N-dimethyl-3-(thieno(2,3-c)(2)benzothiepin-4(9H)-ylidene)-, hydrochloride (1:1)
CAS 1154-12-7C17H20ClNS2
N,N-Dimethyl-3-thieno(2,3-c)(2)benzothiepin-4(9H)-ylidene-1-propanamine chemical structure, C17H19NS2, CAS 5802-61-9
N,N-Dimethyl-3-thieno(2,3-c)(2)benzothiepin-4(9H)-ylidene-1-propanamine
CAS 5802-61-9C17H19NS2
Bisulepin hydrochloride chemical structure, C17H20ClNS2, CAS 42505-74-8
Bisulepin hydrochloride
CAS 42505-74-8C17H20ClNS2
Dithiaden chemical structure, C17H19NS2, CAS 42504-83-6
Dithiaden
CAS 42504-83-6C17H19NS2
Dithiaden S-oxide chemical structure, C17H19NOS2, CAS 11119-54-3
Dithiaden S-oxide
CAS 11119-54-3C17H19NOS2
Thieno(2,3-c)(2)benzothiepin-delta(sup 4(9H),gamma)-propylamine, 6-chloro-N,N-dimethyl-, hydrochloride chemical structure, C17H19Cl2NS2, CAS 15053-17-5
Thieno(2,3-c)(2)benzothiepin-delta(sup 4(9H),gamma)-propylamine, 6-chloro-N,N-dimethyl-, hydrochloride
CAS 15053-17-5C17H19Cl2NS2
Thieno(2,3-c)(2)benzothiepin-delta(sup 4(9H),gamma)-propylamine, 6-bromo-N,N-dimethyl-, hydrochloride chemical structure, C17H19BrClNS2, CAS 15137-26-5
Thieno(2,3-c)(2)benzothiepin-delta(sup 4(9H),gamma)-propylamine, 6-bromo-N,N-dimethyl-, hydrochloride
CAS 15137-26-5C17H19BrClNS2
1-Propanamine, N-methyl-3-thieno(2,3-c)(2)benzothiepin-4(9H)-ylidene- chemical structure, C16H17NS2, CAS 34885-56-8
1-Propanamine, N-methyl-3-thieno(2,3-c)(2)benzothiepin-4(9H)-ylidene-
CAS 34885-56-8C16H17NS2
Bisulepin hydrochloride, (Z)- chemical structure, C17H20ClNS2, CAS 42505-76-0
Bisulepin hydrochloride, (Z)-
CAS 42505-76-0C17H20ClNS2
1-Propanamine, N-methyl-3-thieno(2,3-c)(2)benzothiepin-4(9H)-ylidene-, hydrochloride, (E)- chemical structure, C16H18ClNS2, CAS 42505-78-2
1-Propanamine, N-methyl-3-thieno(2,3-c)(2)benzothiepin-4(9H)-ylidene-, hydrochloride, (E)-
CAS 42505-78-2C16H18ClNS2
1-Propanamine, N,N-dimethyl-3-thieno(2,3-c)(2)benzothiepin-4(9H)-ylidene, (Z)-, (Z)-2-butenedioate (1:1) chemical structure, C21H23NO4S2, CAS 55407-74-4
1-Propanamine, N,N-dimethyl-3-thieno(2,3-c)(2)benzothiepin-4(9H)-ylidene, (Z)-, (Z)-2-butenedioate (1:1)
CAS 55407-74-4C21H23NO4S2
Bisulepine chemical structure, C17H19NS2, CAS 42504-84-7
Bisulepine
CAS 42504-84-7C17H19NS2