CompoundList
Sign in
Murcko scaffold

Ring system with 3 rings and 25 atoms

39 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
25
Chemicals
39
With full pages
4
Scaffold SMILES

O=C(CSc1nnc(CNC(=O)c2ccccc2)[nH]1)c1ccccc1

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)c2ccccc2)[nH]1)c1ccccc1

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 39 of 39 chemicals

N-[(5-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)methyl]-2-methylbenzamide chemical structure, C21H21BrN4O2S, CAS 713097-79-1
N-[(5-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)methyl]-2-methylbenzamide
CAS 713097-79-1C21H21BrN4O2S
N-[(5-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-4-methoxybenzamide chemical structure, C20H19BrN4O3S, CAS 694476-53-4
N-[(5-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-4-methoxybenzamide
CAS 694476-53-4C20H19BrN4O3S
N-[[4-Ethyl-5-[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-3-methylbenzamide chemical structure, C21H21N5O4S, CAS 767326-91-0
N-[[4-Ethyl-5-[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-3-methylbenzamide
CAS 767326-91-0C21H21N5O4S
3,4-Dichloro-N-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide chemical structure, C19H16Cl2N4O2S, CAS 713491-37-3
3,4-Dichloro-N-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide
CAS 713491-37-3C19H16Cl2N4O2S
2-Fluoro-N-[(5-phenacylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)methyl]benzamide chemical structure, C21H19FN4O2S, CAS 713494-06-5
2-Fluoro-N-[(5-phenacylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)methyl]benzamide
CAS 713494-06-5C21H19FN4O2S
N-[[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxybenzamide chemical structure, C22H23BrN4O4S, CAS 713097-53-1
N-[[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxybenzamide
CAS 713097-53-1C22H23BrN4O4S
N-[[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-4-chlorobenzamide chemical structure, C19H16BrClN4O2S, CAS 694465-15-1
N-[[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-4-chlorobenzamide
CAS 694465-15-1C19H16BrClN4O2S
N-[[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxybenzamide chemical structure, C21H21BrN4O4S, CAS 694466-96-1
N-[[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-3,4-dimethoxybenzamide
CAS 694466-96-1C21H21BrN4O4S
N-[(5-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-3-methylbenzamide chemical structure, C20H19BrN4O2S, CAS 665018-60-0
N-[(5-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)methyl]-3-methylbenzamide
CAS 665018-60-0C20H19BrN4O2S
N-[[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-2-fluorobenzamide chemical structure, C19H16BrFN4O2S, CAS 701944-88-9
N-[[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]-2-fluorobenzamide
CAS 701944-88-9C19H16BrFN4O2S
N-[[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide chemical structure, C22H21BrN4O3S, CAS 708292-93-7
N-[[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide
CAS 708292-93-7C22H21BrN4O3S
2-Fluoro-N-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide chemical structure, C19H17FN4O2S, CAS 713500-39-1
2-Fluoro-N-[(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)methyl]benzamide
CAS 713500-39-1C19H17FN4O2S
4-Methoxy-N-[[5-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C21H22N4O4S, CAS 767326-35-2
4-Methoxy-N-[[5-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]methyl]benzamide
CAS 767326-35-2C21H22N4O4S
2-Fluoro-N-[[4-methyl-5-[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C19H16FN5O4S, CAS 767326-88-5
2-Fluoro-N-[[4-methyl-5-[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide
CAS 767326-88-5C19H16FN5O4S
4-Methoxy-N-[[4-methyl-5-[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C20H19N5O5S, CAS 767326-90-9
4-Methoxy-N-[[4-methyl-5-[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]benzamide
CAS 767326-90-9C20H19N5O5S
2-Fluoro-N-[[5-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C22H21FN4O3S, CAS 767325-98-4
2-Fluoro-N-[[5-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]benzamide
CAS 767325-98-4C22H21FN4O3S
2-Fluoro-N-[[5-[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]benzamide chemical structure, C21H18FN5O4S, CAS 832679-83-1
2-Fluoro-N-[[5-[2-(3-nitrophenyl)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]benzamide
CAS 832679-83-1C21H18FN5O4S
N-((4-Ethyl-5-((2-oxo-2-phenylethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-4-methoxybenzamide chemical structure, C21H22N4O3S, CAS 476448-78-9
N-((4-Ethyl-5-((2-oxo-2-phenylethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-4-methoxybenzamide
CAS 476448-78-9C21H22N4O3S
N-[1-[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]-2-methylpropyl]-3-methylbenzamide chemical structure, C23H25BrN4O2S, CAS 694460-28-1
N-[1-[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]-2-methylpropyl]-3-methylbenzamide
CAS 694460-28-1C23H25BrN4O2S
N-[1-[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-3-methylbutyl]-2-chlorobenzamide chemical structure, C24H26BrClN4O2S, CAS 694460-30-5
N-[1-[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-3-methylbutyl]-2-chlorobenzamide
CAS 694460-30-5C24H26BrClN4O2S
N-[1-[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]-2-methylpropyl]-4-chlorobenzamide chemical structure, C22H22BrClN4O2S, CAS 694468-36-5
N-[1-[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]-2-methylpropyl]-4-chlorobenzamide
CAS 694468-36-5C22H22BrClN4O2S
N-[1-(5-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]-4-chlorobenzamide chemical structure, C21H20BrClN4O2S, CAS 713097-28-0
N-[1-(5-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]-4-chlorobenzamide
CAS 713097-28-0C21H20BrClN4O2S
N-[1-[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-2-methylpropyl]-4-methylbenzamide chemical structure, C24H27BrN4O2S, CAS 713098-92-1
N-[1-[5-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]-2-methylpropyl]-4-methylbenzamide
CAS 713098-92-1C24H27BrN4O2S
N-{1-[5-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide chemical structure, C22H21BrN4O2S, CAS 701953-81-3
N-{1-[5-{[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide
CAS 701953-81-3C22H21BrN4O2S