CHEBI:83920 - 4-(4-chlorophenyl)-2-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile

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ChEBI Name 4-(4-chlorophenyl)-2-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile ChEBI ID CHEBI:83920 Definition A member of the class of triazoles that is 1-chloro-4-(3-phenylpropyl)benzene substituted at position 3 of the propyl moiety by cyano and 1,2,4-triazol-1-ylmethyl groups. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C19H17ClN4 Net Charge 0 Average Mass 336.81800 Monoisotopic Mass 336.11417 InChI InChI=1S/C19H17ClN4/c20-18-8-6-16(7-9-18)10-11-19(12-21,13-24-15-22-14-23-24)17-4-2-1-3-5-17/h1-9,14-15H,10-11,13H2 InChIKey RQDJADAKIFFEKQ-UHFFFAOYSA-N SMILES Clc1ccc(CCC(Cn2cncn2)(C#N)c2ccccc2)cc1 ChEBI Ontology Outgoing 4-(4-chlorophenyl)-2-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile (CHEBI:83920) is a monochlorobenzenes (CHEBI:83403) 4-(4-chlorophenyl)-2-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile (CHEBI:83920) is a nitrile (CHEBI:18379) 4-(4-chlorophenyl)-2-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile (CHEBI:83920) is a triazoles (CHEBI:35727) Incoming (R)-fenbuconazole (CHEBI:83922) is a 4-(4-chlorophenyl)-2-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile (CHEBI:83920) (S)-fenbuconazole (CHEBI:83921) is a 4-(4-chlorophenyl)-2-phenyl-2-(1,2,4-triazol-1-ylmethyl)butanenitrile (CHEBI:83920) IUPAC Name 4-(4-chlorophenyl)-2-phenyl-2-(1H-1,2,4-triazol-1-ylmethyl)butanenitrile Manual Xref Database 293 PPDB View more database links Last Modified 27 November 2014