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CHEBI:121278 - N-(4-methoxyphenyl)carbamic acid [(1-tert-butyl-3,5-dimethyl-4-pyrazolyl)methylideneamino] ester

ChEBI IDCHEBI:121278
ChEBI NameN-(4-methoxyphenyl)carbamic acid [(1-tert-butyl-3,5-dimethyl-4-pyrazolyl)methylideneamino] ester
Stars
DownloadsMolfile
FormulaC18H24N4O3
Net Charge0
Average Mass344.415
Monoisotopic Mass344.18484
SMILESCOc1ccc(NC(=O)ON=Cc2c(C)nn(C(C)(C)C)c2C)cc1
InChIInChI=1S/C18H24N4O3/c1-12-16(13(2)22(21-12)18(3,4)5)11-19-25-17(23)20-14-7-9-15(24-6)10-8-14/h7-11H,1-6H3,(H,20,23)
InChIKeyYLMACGWFMBYHMC-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
N-(4-methoxyphenyl)carbamic acid [(1-tert-butyl-3,5-dimethyl-4-pyrazolyl)methylideneamino] ester (CHEBI:121278) is a methoxybenzenes (CHEBI:51683)
N-(4-methoxyphenyl)carbamic acid [(1-tert-butyl-3,5-dimethyl-4-pyrazolyl)methylideneamino] ester (CHEBI:121278) is a substituted aniline (CHEBI:48975)
Manual XrefsDatabases
LSM-32721LINCS