CHEBI:83118 - 5-chloro-1,3-dimethyl-N-(1,1,3-trimethyl-1,3-dihydro-2-benzofuran-4-yl)pyrazole-4-carboxamide

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ChEBI Name 5-chloro-1,3-dimethyl-N-(1,1,3-trimethyl-1,3-dihydro-2-benzofuran-4-yl)pyrazole-4-carboxamide
ChEBI ID CHEBI:83118
ChEBI ASCII Name 5-chloro-1,3-dimethyl-N-(1,1,3-trimethyl-1,3-dihydro-2-benzofuran-4-yl)pyrazole-4-carboxamide
Definition An aromatic amide obtained by formal condensation of the carboxy group of 5-chloro-1,3-dimethylpyrazole-4-carboxylic acid with the amino group of 1,1,3-trimethyl-1,3-dihydro-2-benzofuran-4-amine.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C17H20ClN3O2
Net Charge 0
Average Mass 333.81300
Monoisotopic Mass 333.12440
InChI InChI=1S/C17H20ClN3O2/c1-9-13(15(18)21(5)20-9)16(22)19-12-8-6-7-11-14(12)10(2)23-17(11,3)4/h6-8,10H,1-5H3,(H,19,22)
InChIKey NRTLIYOWLVMQBO-UHFFFAOYSA-N
SMILES CC1OC(C)(C)c2cccc(NC(=O)c3c(C)nn(C)c3Cl)c12
ChEBI Ontology
Outgoing 5-chloro-1,3-dimethyl-N-(1,1,3-trimethyl-1,3-dihydro-2-benzofuran-4-yl)pyrazole-4-carboxamide (CHEBI:83118) is a 1-benzofurans (CHEBI:38830)
5-chloro-1,3-dimethyl-N-(1,1,3-trimethyl-1,3-dihydro-2-benzofuran-4-yl)pyrazole-4-carboxamide (CHEBI:83118) is a aromatic amide (CHEBI:62733)
5-chloro-1,3-dimethyl-N-(1,1,3-trimethyl-1,3-dihydro-2-benzofuran-4-yl)pyrazole-4-carboxamide (CHEBI:83118) is a organochlorine compound (CHEBI:36683)
5-chloro-1,3-dimethyl-N-(1,1,3-trimethyl-1,3-dihydro-2-benzofuran-4-yl)pyrazole-4-carboxamide (CHEBI:83118) is a pyrazoles (CHEBI:26410)
Incoming (R)-furametpyr (CHEBI:83124) is a 5-chloro-1,3-dimethyl-N-(1,1,3-trimethyl-1,3-dihydro-2-benzofuran-4-yl)pyrazole-4-carboxamide (CHEBI:83118)
(S)-furametpyr (CHEBI:83119) is a 5-chloro-1,3-dimethyl-N-(1,1,3-trimethyl-1,3-dihydro-2-benzofuran-4-yl)pyrazole-4-carboxamide (CHEBI:83118)
IUPAC Name
5-chloro-1,3-dimethyl-N-(1,1,3-trimethyl-1,3-dihydro-2-benzofuran-4-yl)-1H-pyrazole-4-carboxamide
Manual Xref Database
1208 PPDB
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Last Modified
23 September 2014