clotrimazole (CHEBI:3764)

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ChEBI Name	clotrimazole

ChEBI ID	CHEBI:3764

Definition	A member of the class of imidazoles that is 1H-imidazole in which the hydrogen attached to a nitrogen is replaced by a monochlorotrityl group.

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C22H17ClN2

Net Charge

Average Mass

344.83700

Monoisotopic Mass

344.10803

InChI

InChI=1S/C22H17ClN2/c23-21-14-8-7-13-20(21)22(25-16-15-24-17-25,18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-17H

InChIKey

VNFPBHJOKIVQEB-UHFFFAOYSA-N

SMILES

Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1

Roles Classification
Chemical Role(s):	environmental contaminant Any minor or unwanted substance introduced into the environment that can have undesired effects.

Biological Role(s):	xenobiotic A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means. antifungal drug Any antifungal agent used to prevent or treat fungal infections in humans or animals. (via conazole antifungal drug ) (via imidazole antifungal drug ) ergosterol biosynthesis inhibitor Any compound that inhibits one or more steps in the pathway leading to the synthesis of ergosterol. (via conazole antifungal agent ) antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. (via conazole antifungal agent ) (via imidazole antifungal agent )

Application(s):	antiinfective agent A substance used in the prophylaxis or therapy of infectious diseases. antifungal drug Any antifungal agent used to prevent or treat fungal infections in humans or animals. (via conazole antifungal drug ) (via imidazole antifungal drug )

ChEBI Ontology
Outgoing	clotrimazole (CHEBI:3764) has role antiinfective agent (CHEBI:35441) clotrimazole (CHEBI:3764) has role environmental contaminant (CHEBI:78298) clotrimazole (CHEBI:3764) has role xenobiotic (CHEBI:35703) clotrimazole (CHEBI:3764) is a conazole antifungal drug (CHEBI:87071) clotrimazole (CHEBI:3764) is a imidazole antifungal drug (CHEBI:87069) clotrimazole (CHEBI:3764) is a imidazoles (CHEBI:24780) clotrimazole (CHEBI:3764) is a monochlorobenzenes (CHEBI:83403)

IUPAC Name

1-[(2-chlorophenyl)(diphenyl)methyl]-1H-imidazole

Synonyms	Sources
1-((2-Chlorophenyl)diphenylmethyl)-1H-imidazole	ChemIDplus
1-(α-(2-Chlorophenyl)benzhydryl)imidazole	NIST Chemistry WebBook
1-(o-Chloro-α,α-diphenylbenzyl)imidazole	NIST Chemistry WebBook
1-(o-Chlorotrityl)imidazole	ChemIDplus
Clotrimazole	KEGG DRUG
Clotrimazole	KEGG COMPOUND
Lotrimin (TN)	KEGG DRUG
Mycelex (TN)	KEGG DRUG

Last Modified

22 February 2017

General Comment
2014-10-29	Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag