CHEBI:83138 - 1-methyl-N-[2-(4-methylpentan-2-yl)-3-thienyl]-3-(trifluoromethyl)pyrazole-4-carboxamide

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ChEBI Name 1-methyl-N-[2-(4-methylpentan-2-yl)-3-thienyl]-3-(trifluoromethyl)pyrazole-4-carboxamide
ChEBI ID CHEBI:83138
ChEBI ASCII Name 1-methyl-N-[2-(4-methylpentan-2-yl)-3-thienyl]-3-(trifluoromethyl)pyrazole-4-carboxamide
Definition An aromatic amide obtained by formal condensation of the carboxy group of 1-methyl-3-(trifluoromethyl)pyrazole-4-carboxylic acid with the amino group of 2-(4-methylpentan-2-yl)thiophen-3-amine.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C16H20F3N3OS
Net Charge 0
Average Mass 359.41000
Monoisotopic Mass 359.128
InChI InChI=1S/C16H20F3N3OS/c1-9(2)7-10(3)13-12(5-6-24-13)20-15(23)11-8-22(4)21-14(11)16(17,18)19/h5-6,8-10H,7H2,1-4H3,(H,20,23)
InChIKey PFFIDZXUXFLSSR-UHFFFAOYSA-N
SMILES CC(C)CC(C)c1sccc1NC(=O)c1cn(C)nc1C(F)(F)F
ChEBI Ontology
Outgoing 1-methyl-N-[2-(4-methylpentan-2-yl)-3-thienyl]-3-(trifluoromethyl)pyrazole-4-carboxamide (CHEBI:83138) is a aromatic amide (CHEBI:62733)
1-methyl-N-[2-(4-methylpentan-2-yl)-3-thienyl]-3-(trifluoromethyl)pyrazole-4-carboxamide (CHEBI:83138) is a organofluorine compound (CHEBI:37143)
1-methyl-N-[2-(4-methylpentan-2-yl)-3-thienyl]-3-(trifluoromethyl)pyrazole-4-carboxamide (CHEBI:83138) is a pyrazoles (CHEBI:26410)
1-methyl-N-[2-(4-methylpentan-2-yl)-3-thienyl]-3-(trifluoromethyl)pyrazole-4-carboxamide (CHEBI:83138) is a thiophenes (CHEBI:26961)
Incoming (R)-penthiopyrad (CHEBI:83141) is a 1-methyl-N-[2-(4-methylpentan-2-yl)-3-thienyl]-3-(trifluoromethyl)pyrazole-4-carboxamide (CHEBI:83138)
(S)-penthiopyrad (CHEBI:83140) is a 1-methyl-N-[2-(4-methylpentan-2-yl)-3-thienyl]-3-(trifluoromethyl)pyrazole-4-carboxamide (CHEBI:83138)
IUPAC Name
1-methyl-N-[2-(4-methylpentan-2-yl)-3-thienyl]-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide
Manual Xref Database
1210 PPDB
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Last Modified
24 September 2014