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Murcko scaffold

Ring system with 3 rings and 25 atoms

12 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
25
Chemicals
12
With full pages
3
Scaffold SMILES

O=C(CSc1nnc(CNC(=O)c2ccco2)[nH]1)Nc1ccccc1

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(CSc1nnc(CNC(=O)c2ccco2)[nH]1)Nc1ccccc1

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

N-[[5-[2-(2-Bromo-4,6-difluoroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide chemical structure, C17H14BrF2N5O3S, CAS 708249-93-8
N-[[5-[2-(2-Bromo-4,6-difluoroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
CAS 708249-93-8C17H14BrF2N5O3S
N-[[5-[2-(4-Ethoxyanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide chemical structure, C20H23N5O4S, CAS 767324-21-0
N-[[5-[2-(4-Ethoxyanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
CAS 767324-21-0C20H23N5O4S
N-[[5-[2-(2-Bromo-4,5-dimethylanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide chemical structure, C20H22BrN5O3S, CAS 708250-84-4
N-[[5-[2-(2-Bromo-4,5-dimethylanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
CAS 708250-84-4C20H22BrN5O3S
N-[[5-[2-(4-Bromo-3-chloroanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide chemical structure, C19H17BrClN5O3S, CAS 708245-15-2
N-[[5-[2-(4-Bromo-3-chloroanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
CAS 708245-15-2C19H17BrClN5O3S
N-[[5-[2-(4-Iodoanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide chemical structure, C17H16IN5O3S, CAS 708251-73-4
N-[[5-[2-(4-Iodoanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
CAS 708251-73-4C17H16IN5O3S
N-[[4-Ethyl-5-[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide chemical structure, C19H21N5O4S, CAS 708252-96-4
N-[[4-Ethyl-5-[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
CAS 708252-96-4C19H21N5O4S
N-({5-[(2-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-2-oxoethyl)thio]-4-ethyl-4H-1,2,4-triazol-3-yl}methyl)-2-furamide chemical structure, C19H17ClF3N5O3S, CAS 708996-80-9
N-({5-[(2-{[2-Chloro-5-(trifluoromethyl)phenyl]amino}-2-oxoethyl)thio]-4-ethyl-4H-1,2,4-triazol-3-yl}methyl)-2-furamide
CAS 708996-80-9C19H17ClF3N5O3S
N-[[4-Methyl-5-[2-(4-methyl-3-nitroanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide chemical structure, C18H18N6O5S, CAS 792943-72-7
N-[[4-Methyl-5-[2-(4-methyl-3-nitroanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
CAS 792943-72-7C18H18N6O5S
N-[[5-[2-(3-Bromoanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide chemical structure, C19H18BrN5O3S, CAS 767327-04-8
N-[[5-[2-(3-Bromoanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
CAS 767327-04-8C19H18BrN5O3S
N-[[5-[2-(3-Fluoroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide chemical structure, C17H16FN5O3S, CAS 767325-92-8
N-[[5-[2-(3-Fluoroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
CAS 767325-92-8C17H16FN5O3S
N-[[4-Methyl-5-[2-(4-nitroanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide chemical structure, C17H16N6O5S, CAS 708244-67-1
N-[[4-Methyl-5-[2-(4-nitroanilino)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
CAS 708244-67-1C17H16N6O5S
Propan-2-yl 3-[({[5-{[(furan-2-ylcarbonyl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate chemical structure, C23H25N5O5S, CAS 708251-97-2
Propan-2-yl 3-[({[5-{[(furan-2-ylcarbonyl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
CAS 708251-97-2C23H25N5O5S