CHEBI:228238 - chloroinconazide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name chloroinconazide
ChEBI ID CHEBI:228238
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H19ClN4O
Net Charge 0
Average Mass 366.850
Monoisotopic Mass 366.12474
InChI InChI=1S/C20H19ClN4O/c1-12-19-16(15-4-2-3-5-17(15)24-19)10-18(23-12)20(26)25-22-11-13-6-8-14(21)9-7-13/h2-9,11-12,18,23-24H,10H2,1H3,(H,25,26)/b22-11+/t12?,18-/m0/s1
InChIKey KMNVHTXBKWKMBA-KMRULJOSSA-N
SMILES CC1N[C@@H](CC2=C1NC1=C2C=CC=C1)C(=O)N\N=C\C1=CC=C(Cl)C=C1
Roles Classification
Biological Role(s): fungicide
A substance used to destroy fungal pests.
antiviral agent
A substance that destroys or inhibits replication of viruses.
Application(s): fungicide
A substance used to destroy fungal pests.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing chloroinconazide (CHEBI:228238) has role antiviral agent (CHEBI:22587)
chloroinconazide (CHEBI:228238) has role fungicide (CHEBI:24127)
chloroinconazide (CHEBI:228238) is a β-carbolines (CHEBI:60834)
chloroinconazide (CHEBI:228238) is a carbohydrazide (CHEBI:35363)
chloroinconazide (CHEBI:228238) is a monochlorobenzenes (CHEBI:83403)
IUPAC Name
(1RS,3S)-N'-[(E)-(4-chlorobenzylidene)]-2,3,4,9-tetrahydro-1-methyl-1H-pyrido[3,4-b]indole-3-carbohydrazide
Synonyms Sources
(1Ξ,3S)-N'-[(E)-(4-chlorophenyl)methylidene]-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carbohydrazide Alan Wood's Pesticides
(3S)-2,3,4,9-tetrahydro-1-methyl-1H-pyrido[3,4-b]indole-3-carboxylic acid (2E)-2-[(4-chlorophenyl)methylene]hydrazide Alan Wood's Pesticides
(3S)-N'-[(E)-(4-chlorophenyl)methylidene]-1-methyl-2,3,4,9-tetrahydro-1H-β-carboline-3-carbohydrazide IUPAC
Manual Xrefs Databases
3464 PPDB
chloroinconazide Alan Wood's Pesticides
View more database links
Registry Numbers Types Sources
2442449-10-5 CAS Registry Number Alan Wood's Pesticides
55193976 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
32418274 PubMed citation Europe PMC
33904309 PubMed citation Europe PMC
34370905 PubMed citation Europe PMC
36070563 PubMed citation Europe PMC
Last Modified
20 November 2023