1-(3-tert-butyl-1-methylpyrazol-5-yl)-3-(4-chlorophenyl)urea (CHEBI:47249)

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ChEBI Name	*1-(3-tert-butyl-1-methylpyrazol-5-yl)-3-(4-chlorophenyl)urea*

ChEBI ID	CHEBI:47249

ChEBI ASCII Name	1-(3-tert-butyl-1-methylpyrazol-5-yl)-3-(4-chlorophenyl)urea

Definition	A member of the class of phenylureas that is urea which is substituted at position 1 by a 3-tert-butyl-1-methylpyrazol-5-yl group and at position 3 by a p-chlorophenyl group.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

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Formula

C15H19ClN4O

Net Charge

Average Mass

306.791

Monoisotopic Mass

306.12474

InChI

InChI=1S/C15H19ClN4O/c1-15(2,3)12-9-13(20(4)19-12)18-14(21)17-11-7-5-10(16)6-8-11/h5-9H,1-4H3,(H2,17,18,21)

InChIKey

FWIJKWMXNHRSRO-UHFFFAOYSA-N

SMILES

C(=O)(NC=1N(N=C(C1)C(C)(C)C)C)NC2=CC=C(C=C2)Cl

Roles Classification
Biological Role(s):	EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of mitogen-activated protein kinase (EC 2.7.11.24).

ChEBI Ontology
Outgoing	1-(3-tert-butyl-1-methylpyrazol-5-yl)-3-(4-chlorophenyl)urea (CHEBI:47249) has role EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor (CHEBI:79091) 1-(3-tert-butyl-1-methylpyrazol-5-yl)-3-(4-chlorophenyl)urea (CHEBI:47249) is a monochlorobenzenes (CHEBI:83403) 1-(3-tert-butyl-1-methylpyrazol-5-yl)-3-(4-chlorophenyl)urea (CHEBI:47249) is a phenylureas (CHEBI:134043) 1-(3-tert-butyl-1-methylpyrazol-5-yl)-3-(4-chlorophenyl)urea (CHEBI:47249) is a pyrazoles (CHEBI:26410)

IUPAC Name

1-(3-tert-butyl-1-methyl-1H-pyrazol-5-yl)-3-(4-chlorophenyl)urea

Synonym	Source
1-(5-TERT-BUTYL-2-METHYL-2H-PYRAZOL-3-YL)-3-(4-CHLORO-PHENYL)-UREA	PDBeChem

Registry Number	Type	Source
9135759	Reaxys Registry Number	Reaxys

Citation	Type	Source
11896401	PubMed citation	Europe PMC

Last Modified

26 November 2016