Free for buyers, contact details stay privateFree for buyers. Your contact details stay private until you accept a quote.

Sign in Join free

Murcko scaffold

Ring system with 5 rings and 35 atoms

23 chemicals on CompoundList share this ring system.

Rings: 5
Scaffold atoms: 35
Chemicals: 23
With full pages: 5

Scaffold SMILES

O=C(Nc1cccc(Nc2nccc(-c3cccnc3)n2)c1)c1ccc(CN2CCNCC2)cc1

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(Nc1cccc(Nc2nccc(-c3cccnc3)n2)c1)c1ccc(CN2CCNCC2)cc1

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 23 of 23 chemicals

Imatinib chemical structure, C29H31N7O, CAS 152459-95-5

CAS 152459-95-5C₂₉H₃₁N₇O

Imatinib mesylate chemical structure, C30H35N7O4S, CAS 220127-57-1

Imatinib mesylate

CAS 220127-57-1C₃₀H₃₅N₇O₄S

Imatinib (Pyridine)-N-oxide chemical structure, C29H31N7O2, CAS 571186-92-0

Imatinib (Pyridine)-N-oxide

CAS 571186-92-0C₂₉H₃₁N₇O₂

Cgp-74588 chemical structure, C28H29N7O, CAS 404844-02-6

CAS 404844-02-6C₂₈H₂₉N₇O

N-Desmethyl imatinib mesylate chemical structure, C29H33N7O4S, CAS 404844-03-7

N-Desmethyl imatinib mesylate

CAS 404844-03-7C₂₉H₃₃N₇O₄S

Imatinib hydrochloride chemical structure, C29H32ClN7O, CAS 862366-25-4

Imatinib hydrochloride

CAS 862366-25-4C₂₉H₃₂ClN₇O

Imatinib impurity 4 chemical structure, C30H33N7O, CAS 942514-62-7

Imatinib impurity 4

CAS 942514-62-7C₃₀H₃₃N₇O

Benzamide, N-[4-methyl-3-[[4-(6-methyl-3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-4-[(4-methyl-1-piperazinyl)methyl]- chemical structure, C30H33N7O, CAS 1032314-85-4

Benzamide, N-[4-methyl-3-[[4-(6-methyl-3-pyridinyl)-2-pyrimidinyl]amino]phenyl]-4-[(4-methyl-1-piperazinyl)methyl]-

CAS 1032314-85-4C₃₀H₃₃N₇O

Imatinib D4 chemical structure, C29H31N7O, CAS 1134803-16-9

CAS 1134803-16-9C₂₉H₃₁N₇O

Imatinib-d8 chemical structure, C29H31N7O, CAS 1092942-82-9

CAS 1092942-82-9C₂₉H₃₁N₇O

Genfatinib-d3 (imatinib-d3) chemical structure, C29H31N7O, CAS 1134803-18-1

Genfatinib-d3 (imatinib-d3)

CAS 1134803-18-1C₂₉H₃₁N₇O

4-[(4-Methyl-4-oxidopiperazin-4-ium-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide chemical structure, C29H31N7O2, CAS 571186-91-9

4-[(4-Methyl-4-oxidopiperazin-4-ium-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide

CAS 571186-91-9C₂₉H₃₁N₇O₂

N-Desmethyl imatinib-d8 chemical structure, C28H29N7O, CAS 1185103-28-9

N-Desmethyl imatinib-d8

CAS 1185103-28-9C₂₈H₂₉N₇O

N-Boc-N-Desmethyl Imatinib chemical structure, C33H37N7O3, CAS 1076199-23-9

N-Boc-N-Desmethyl Imatinib

CAS 1076199-23-9C₃₃H₃₇N₇O₃

4-[(4-Acetyl-1-piperazinyl)methyl]-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]benzamide chemical structure, C30H31N7O2, CAS 1321600-77-4

4-[(4-Acetyl-1-piperazinyl)methyl]-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]benzamide

CAS 1321600-77-4C₃₀H₃₁N₇O₂

N-[3-[Acetyl[4-(3-pyridinyl)-2-pyrimidinyl]amino]-4-methylphenyl]-4-[(4-methyl-1-piperazinyl)methyl]benzamide chemical structure, C31H33N7O2, CAS 1321600-78-5

N-[3-[Acetyl[4-(3-pyridinyl)-2-pyrimidinyl]amino]-4-methylphenyl]-4-[(4-methyl-1-piperazinyl)methyl]benzamide

CAS 1321600-78-5C₃₁H₃₃N₇O₂

Imatinib regioisomer 2 chemical structure, C29H31N7O, CAS 1349250-06-1

Imatinib regioisomer 2

CAS 1349250-06-1C₂₉H₃₁N₇O

Gleevec-d8 mesylate (imatinib-d8 mesylate) chemical structure, C30H35N7O4S, CAS 1092942-83-0

Gleevec-d8 mesylate (imatinib-d8 mesylate)

CAS 1092942-83-0C₃₀H₃₅N₇O₄S

Imatinib (piperazine)-N1-oxide chemical structure, C29H31N7O2, CAS 938082-57-6

Imatinib (piperazine)-N1-oxide

CAS 938082-57-6C₂₉H₃₁N₇O₂

4-((4-Methyl-1,4-dioxido-1-piperazinyl)methyl)-N-(4-methyl-3-((4-(3-pyridinyl)-2-pyrimidinyl)amino)phenyl)benzamide chemical structure, C29H31N7O3, CAS 571186-93-1

4-((4-Methyl-1,4-dioxido-1-piperazinyl)methyl)-N-(4-methyl-3-((4-(3-pyridinyl)-2-pyrimidinyl)amino)phenyl)benzamide

CAS 571186-93-1C₂₉H₃₁N₇O₃

N-Formyl imatinib chemical structure, C29H29N7O2, CAS 1436868-85-7

N-Formyl imatinib

CAS 1436868-85-7C₂₉H₂₉N₇O₂

Imatinib acid chemical structure, C31H33N7O3, CAS 2741007-77-0

CAS 2741007-77-0C₃₁H₃₃N₇O₃

N-Desmethyl N-nitroso imatinib chemical structure, C28H28N8O2, CAS 2816369-80-7

N-Desmethyl N-nitroso imatinib

CAS 2816369-80-7C₂₈H₂₈N₈O₂