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101530-10-3,MFCD00865590
Catalog No.:AA0004NO
101530-10-3 | 1H-Imidazole-1-acetonitrile, α-[4-(2-chlorophenyl)-1,3-dithiolan-2-ylidene]-, (αE)-
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5mg
98%(HPLC)
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10mg
98%(HPLC)
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25mg
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  • Technical Information
  • Properties
  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0004NO
Chemical Name:
1H-Imidazole-1-acetonitrile, α-[4-(2-chlorophenyl)-1,3-dithiolan-2-ylidene]-, (αE)-
CAS Number:
101530-10-3
Molecular Formula:
C14H10ClN3S2
Molecular Weight:
319.8323
MDL Number:
MFCD00865590
IUPAC Name:
(2E)-2-[4-(2-chlorophenyl)-1,3-dithiolan-2-ylidene]-2-imidazol-1-ylacetonitrile
InChI:
InChI=1S/C14H10ClN3S2/c15-11-4-2-1-3-10(11)13-8-19-14(20-13)12(7-16)18-6-5-17-9-18/h1-6,9,13H,8H2/b14-12+
InChI Key:
ZRTQSJFIDWNVJW-WYMLVPIESA-N
SMILES:
N#C/C(=C\1/SCC(S1)c1ccccc1Cl)/n1cncc1
Properties
Computed Properties
 
Complexity:
445  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
319g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.825g/mol
Monoisotopic Mass:
319g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
92.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

Synonyms
 
(4-(2-chlorophenyl)-1,3-dithiolan-2-ylidene)-1-imidazolylacetonitrile 
lanoconazole 
Astat 
NND-318 
TJN-318 
Lanoconazole [INN] 
C14H10ClN3S2 
BRN 4819111 
126509-69-1 
(+-)-(E)-(4-(2-Chlorophenyl)-1,3-dithiolan-2-ylidene)-1-imidazolylacetonitrile 
(E)-alpha-(4-(2-Chlorophenyl)-1,3-dithiolan-2-ylidene)-1H-imidazole-1-acetonitrile 
[4-(2-Chloro-phenyl)-1,3-dithiolan-2-ylidene]-2-imidazol-1-yl-acetonitrile 
latoconazole 
(+-)-alpha-((E)-4-(o-Chlorophenyl)-1,3-dithiolan-2-ylidene)imidazole-1-acetonitrile 
(2E)-2-[4-(2-chlorophenyl)-1,3-dithiolan-2-ylidene]-2-imidazol-1-yl-acetonitrile 
1H-Imidazole-1-acetonitrile, alpha-(4-(2-chlorophenyl)-1,3-dithiolan-2-ylidene)-, (alphaE)- 
()--[(E)-4-(o-Chlorophenyl)-1,3-dithiolan-2-ylidene]imidazole-1-acetonitrile;()--[(E)-4-(o-Chlorophenyl)-1,3-dithiolan-2-ylidene]imidazole-1-acetonitrile 
1H-Imidazole-1-acetonitrile, alpha-(4-(2-chlorophenyl)-1,3-dithiolan-2-ylidene)-, (E)-(+-)- 
latoconazole, (E)-isomer 
Latoconazolum 
NCGC00164544-01 
1H-Imidazole-1-acetonitrile, alpha-[4-(2-chlorophenyl)-1,3-dithiolan-2-ylidene]-, (alphaE)- 
Astat (TN) 
latoconazole, (E)-isomer 
AC1MHEBY 
Lanoconazole (JAN/INN) 
(4-(2-Chlorophenyl)-1,3-dithiolan-2-ylidene)-1-imidazolylacetonitrile 
SCHEMBL342635 
CHEMBL1555126 
CHEBI:31761 
CL0037 
AKOS015900193 
AC-5318 
API0003122 
latoconazole, (Z)-isomer 
1H-Imidazole-1-acetonitrile, alpha-(4-(2-chlorophenyl)-1,3-dithiolan-2-ylidene)- 
AN-11081 
AS-12927 
BC219328 
LS-78020 
D01092 
Lanoconazole, VETRANAL(TM), analytical standard 
530L103 
A800400 
SR-01000945047 
NND 318 
J-000422 
SR-01000945047-1 
(2E)-2-[4-(2-chlorophenyl)-1,3-dithiolan-2-ylidene]-2-(1-imidazolyl)acetonitrile 
(2E)-2-[4-(2-chlorophenyl)-1,3-dithiolan-2-ylidene]-2-imidazol-1-yl-ethanenitrile 
(2E)-2-[4-(2-chlorophenyl)-1,3-dithiolan-2-ylidene]-2-imidazol-1-ylacetonitrile 
(E)-(+/-)-|A-[4-(2-Chlorophenyl)-1,3-dithiolan-2-ylidene]-1H-imidazole-1-acetonitrile 
2-[4-(2-Chlorophenyl)-1,3-dithiolan-2-ylidene]-2-imidazol-1-yl-acetonitrile 
alpha-[4-(2-Chlorophenyl)-1,3-dithiolane-2-ylidene]-1H-imidazole-1-acetonitrile 
latoconazole, (Z)-isomer 
UNII-4E7858311F 
NND-318 
NND 318 
C14-H10-Cl-N3-S2 
CID3002820 
4E7858311F 
C072774 
(alpha E)-alpha-[4-(2-Chlorophenyl)-1,3-dithiolan-2-ylidene]-1H-imidazole-1-acetonitrile 
(E)-(4-(2-Chlorophenyl)-1,3-diathiolan-2-ylidene)-1-imidazolylacetonitrile 
(E)-[4-(2-Chlorophenyl)-1,3-diathiolan-2-ylidene]-1 -imidazolylacetonitrile 
(E)-[4-(2-Chlorophenyl)-1,3-diathiolan-2-ylidene]-1-imidazolylacetonitrile 
153222-93-6 
lanoconazole 
Latoconazole 
101530-10-3 
Literature

Title: Utilization of human nuclear receptors as an early counter screen for off-target activity: a case study with a compendium of 615 known drugs.

Journal: Toxicological sciences : an official journal of the Society of Toxicology 20150601

Title: Comparison of the in vitro activity of terbinafine and lanoconazole against dermatophytes.

Journal: Mycoses 20100701

Title: Efficacy of terbinafine compared to lanoconazole and luliconazole in the topical treatment of dermatophytosis in a guinea pig model.

Journal: Medical mycology 20100501

Title: Triterpene alcohol and fatty acid composition of shea nuts from seven African countries.

Journal: Journal of oleo science 20100101

Title: Separation and quantitation of Z-isomer in lanoconazole by normal phase HPLC.

Journal: Journal of pharmaceutical and biomedical analysis 20091015

Title: Contact dermatitis due to lanoconazole, cetyl alcohol and diethyl sebacate in lanoconazole cream.

Journal: Contact dermatitis 20040101

Title: A case of kerion celsi due to Arthroderma benhamiae identified by DNA sequences of nuclear ribosomal internal transcribed spacer 1 regions.

Journal: Medical mycology 20030601

Title: In vitro activity of novel imidazole antifungal agent NND-502 against Malassezia species.

Journal: International journal of antimicrobial agents 20030301

Title: Development of a new medium useful for the recovery of dermatophytes from clinical specimens by minimizing the carryover effect of antifungal agents.

Journal: Microbiology and immunology 20020101

Title: [Fungicidal activity of liranaftate against Trichophyton rubrum].

Journal: Nihon Ishinkin Gakkai zasshi = Japanese journal of medical mycology 20020101

Title: A novel method using micropig stratum corneum in vitro for the evaluation of anti-Trichophyton mentagrophytes activity.

Journal: Microbiology and immunology 20020101

Title: Synergy of lysozyme and lanoconazole on the morphology of Candida albicans.

Journal: Journal of electron microscopy 20010101

Title: Usefulness of lanoconazole (Astat) cream in the treatment of hyperkeratotic type tinea pedis. Comparative study of monotherapy and combination therapy with 10% urea ointment (Pastaron).

Journal: Mycoses 20010101

Title: Lanoconazole, a new imidazole antimycotic compound, protects MAIDS mice against encephalitis caused by Cryptococcus neoformans.

Journal: The Journal of antimicrobial chemotherapy 20000901

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