CHEBI:83909 - (1E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol

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ChEBI Name (1E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol
ChEBI ID CHEBI:83909
ChEBI ASCII Name (1E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol
Definition A member of the class of triazoles that is 4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol substituted at position 1 by a 2,4-dichlorophenyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C15H17Cl2N3O
Net Charge 0
Average Mass 326.22100
Monoisotopic Mass 325.07487
InChI InChI=1S/C15H17Cl2N3O/c1-15(2,3)14(21)13(20-9-18-8-19-20)6-10-4-5-11(16)7-12(10)17/h4-9,14,21H,1-3H3/b13-6+
InChIKey FBOUIAKEJMZPQG-AWNIVKPZSA-N
SMILES CC(C)(C)C(O)C(=C/c1ccc(Cl)cc1Cl)\n1cncn1
ChEBI Ontology
Outgoing (1E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol (CHEBI:83909) is a dichlorobenzene (CHEBI:23697)
(1E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol (CHEBI:83909) is a olefinic compound (CHEBI:78840)
(1E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol (CHEBI:83909) is a secondary alcohol (CHEBI:35681)
(1E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol (CHEBI:83909) is a triazoles (CHEBI:35727)
Incoming (S)-diniconazole (CHEBI:83906) is a (1E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol (CHEBI:83909)
diniconazole-M (CHEBI:83911) is a (1E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pent-1-en-3-ol (CHEBI:83909)
IUPAC Name
(1E)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pent-1-en-3-ol
Manual Xref Database
247 PPDB
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Last Modified
27 November 2014