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Murcko scaffold

Ring system with 3 rings and 17 atoms

56 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
17
Chemicals
56
With full pages
8
Scaffold SMILES

S=c1nc(-c2ccccc2)[nH]c2c1CCCC2

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=c1nc(-c2ccccc2)[nH]c2c1CCCC2

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 48 of 56 chemicals

1-Isopropyl-2-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C17H20N2S, CAS 371218-86-9
1-Isopropyl-2-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 371218-86-9C17H20N2S
1-(2-(Dimethylamino)ethyl)-2-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C18H23N3S, CAS 94030-21-4
1-(2-(Dimethylamino)ethyl)-2-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 94030-21-4C18H23N3S
2-[2-(3-Nitrophenyl)-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl]acetic acid chemical structure, C16H15N3O4S, CAS 462069-18-7
2-[2-(3-Nitrophenyl)-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl]acetic acid
CAS 462069-18-7C16H15N3O4S
1-Isobutyl-2-phenyl-5,6,7,8-tetrahydro-4(1H)-quinazolinethione chemical structure, C18H22N2S, CAS 501105-88-0
1-Isobutyl-2-phenyl-5,6,7,8-tetrahydro-4(1H)-quinazolinethione
CAS 501105-88-0C18H22N2S
1-(2-Hydroxyethyl)-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C16H17N3O3S, CAS 433322-72-6
1-(2-Hydroxyethyl)-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 433322-72-6C16H17N3O3S
1-Isobutyl-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C18H21N3O2S, CAS 433690-72-3
1-Isobutyl-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 433690-72-3C18H21N3O2S
1-Isobutyl-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C18H21N3O2S, CAS 433941-41-4
1-Isobutyl-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 433941-41-4C18H21N3O2S
1-Isopropyl-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C17H19N3O2S, CAS 446277-60-7
1-Isopropyl-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 446277-60-7C17H19N3O2S
1-Isopropyl-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C17H19N3O2S, CAS 433964-16-0
1-Isopropyl-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 433964-16-0C17H19N3O2S
1-Allyl-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C17H17N3O2S, CAS 616214-31-4
1-Allyl-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 616214-31-4C17H17N3O2S
1-[3-(Dimethylamino)propyl]-2-phenyl-5,6,7,8-tetrahydroquinazoline-4-thione chemical structure, C19H25N3S, CAS 844454-12-2
1-[3-(Dimethylamino)propyl]-2-phenyl-5,6,7,8-tetrahydroquinazoline-4-thione
CAS 844454-12-2C19H25N3S
1-Allyl-2-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C17H18N2S, CAS 848680-62-6
1-Allyl-2-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 848680-62-6C17H18N2S
1-Allyl-2-(4-bromophenyl)-5,6,7,8-tetrahydro-4(1H)-quinazolinethione chemical structure, C17H17BrN2S, CAS 618396-51-3
1-Allyl-2-(4-bromophenyl)-5,6,7,8-tetrahydro-4(1H)-quinazolinethione
CAS 618396-51-3C17H17BrN2S
2-(4-Bromophenyl)-1-(3-(dimethylamino)propyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C19H24BrN3S, CAS 620590-16-1
2-(4-Bromophenyl)-1-(3-(dimethylamino)propyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 620590-16-1C19H24BrN3S
2-(2-(4-Bromophenyl)-4-thioxo-5,6,7,8-tetrahydroquinazolin-1(4H)-yl)acetic acid chemical structure, C16H15BrN2O2S, CAS 620590-18-3
2-(2-(4-Bromophenyl)-4-thioxo-5,6,7,8-tetrahydroquinazolin-1(4H)-yl)acetic acid
CAS 620590-18-3C16H15BrN2O2S
4-[2-(4-Bromophenyl)-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl]butanoic acid chemical structure, C18H19BrN2O2S, CAS 620590-19-4
4-[2-(4-Bromophenyl)-4-sulfanylidene-5,6,7,8-tetrahydroquinazolin-1-yl]butanoic acid
CAS 620590-19-4C18H19BrN2O2S
4-(2-(3-Nitrophenyl)-4-thioxo-5,6,7,8-tetrahydroquinazolin-1(4H)-yl)butanoic acid chemical structure, C18H19N3O4S, CAS 538338-51-1
4-(2-(3-Nitrophenyl)-4-thioxo-5,6,7,8-tetrahydroquinazolin-1(4H)-yl)butanoic acid
CAS 538338-51-1C18H19N3O4S
2-(4-Bromophenyl)-1-isobutyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C18H21BrN2S, CAS 618396-61-5
2-(4-Bromophenyl)-1-isobutyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 618396-61-5C18H21BrN2S
1-(3-(Dimethylamino)propyl)-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C19H24N4O2S, CAS 537680-84-5
1-(3-(Dimethylamino)propyl)-2-(4-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 537680-84-5C19H24N4O2S
1-Allyl-2-(3-methoxyphenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C18H20N2OS, CAS 831229-33-5
1-Allyl-2-(3-methoxyphenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 831229-33-5C18H20N2OS
1-(3-(Dimethylamino)propyl)-2-(3-methoxyphenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C20H27N3OS, CAS 710985-83-4
1-(3-(Dimethylamino)propyl)-2-(3-methoxyphenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 710985-83-4C20H27N3OS
1-(3-Hydroxypropyl)-2-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C17H20N2OS, CAS 397879-67-3
1-(3-Hydroxypropyl)-2-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 397879-67-3C17H20N2OS
1-(3-Hydroxypropyl)-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C17H19N3O3S, CAS 538338-50-0
1-(3-Hydroxypropyl)-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 538338-50-0C17H19N3O3S
1-(2-Methoxyethyl)-2-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione chemical structure, C17H20N2OS, CAS 685551-22-8
1-(2-Methoxyethyl)-2-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
CAS 685551-22-8C17H20N2OS