chloroinconazide

CHEBI:228238 ·resolve ·ANTIFUNGAL ·EXACT SEEDED

Machine-generated and unreviewed. Identity, structure and cross-references come straight from ChEBI's and CARD's own data; no curator has signed off on this record yet.

Classification

Strictly broader compounds or drug classes this molecule belongs to.

CHEBI:35363 CHEBI:35363
CHEBI:60834 CHEBI:60834
CHEBI:83403 CHEBI:83403

Chemical structure

Computed structure properties
Molecular formula	C20H19ClN4O
Charge	0
Average mass	366.852 Da
Monoisotopic mass	366.12474 Da
Source	ChEBI
InChIKey	KMNVHTXBKWKMBA-KMRULJOSSA-N

SMILES

CC1N[C@H](C(=O)N/N=C/c2ccc(Cl)cc2)Cc2c1nc1ccccc21

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

Also called

(1RS,3S)-N'-[(E)-(4-chlorobenzylidene)]-2,3,4,9-tetrahydro-1-methyl-1H-pyrido[3,4-b]indole-3-carbohydrazide (EXACT_SYNONYM)— chebi
(1Ξ,3S)-N'-[(E)-(4-chlorophenyl)methylidene]-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carbohydrazide (EXACT_SYNONYM)— chebi
(3S)-2,3,4,9-tetrahydro-1-methyl-1H-pyrido[3,4-b]indole-3-carboxylic acid (2E)-2-[(4-chlorophenyl)methylene]hydrazide (EXACT_SYNONYM)— chebi
(3S)-N'-[(E)-(4-chlorophenyl)methylidene]-1-methyl-2,3,4,9-tetrahydro-1H-β-carboline-3-carbohydrazide (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

cas:2442449-10-5
pesticides:chloroinconazide
ppdb:3464
reaxys:55193976

Activity roles

Every antimicrobial role a source asserts for this compound — the unreduced evidence behind its antimicrobial_class.

CHEBI:22587 CHEBI:22587
CHEBI:24127 CHEBI:24127

Source concepts

Every upstream concept that resolved to this record. The merge is the product: this is what shows ChEBI and CARD are describing the same structure.

Upstream concepts merged into this record
Source	Native ID	Label	Minted CURIE	Version
CHEBI	`CHEBI:228238`	chloroinconazide	`antibioticmech:chebi-efd4131d0a`	2026-08-30

Curation history

SEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Seeded from data/raw/ inventories (CHEBI)
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories

Provenance

Seeded by scripts/seed_from_sources.py from the committed inventories in data/raw/. View the record.