Astemizole

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Systematic / IUPAC Name: 1-(4-Fluorobenzyl)-N-{1-[2-(4-methoxyphenyl)ethyl]-4-piperidinyl}-1H-benzimidazol-2-amine

ID: Reference1890

Other Names: Histaminos;
Paralergin;
Alermizol;
Astemison;
Laridal ; more

Formula: C28H31FN4O

Class: Therapeutics/Prescription Drugs

Spectral Data

Astemizole mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 39
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/16/2015 10:59:35 AM
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Identificators

InChI InChI=1S/C28H31FN4O/c1-34-25-12-8-21(9-13-25)14-17-32-18-15-24(16-19-32)30-28-31-26-4-2-3-5-27(26)33(28)20-22-6-10-23(29)11-7-22/h2-13,24H,14-20H2,1H3,(H,30,31)
InChI Key GXDALQBWZGODGZ-UHFFFAOYSA-N
Canonical SMILES COC1=CC=C(C=C1)CCN2CCC(CC2)NC3=NC4=CC=CC=C4N3CC5=CC=C(C=C5)F
CAS 68844779
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Other Names Histaminos;
Paralergin;
Alermizol;
Astemison;
Laridal;
Retolen;
Astemizol;
Histamen;
Kelp;
Hestazol;
Metodih;
Wareezol;
Novo-mastizol A;
Astemisan;
Astemisol;
Histazol;
Metodik;
Waruzol;
Nono-nastizol A;
1-(p-Fluorobenzyl)-2-{[1-(p-methoxyphenethyl)-4-piperidyl]amino}benzimidazole;
1-(p-Fluorobenzyl)-2-({1-[2-(p-methoxyphenyl)ethyl]piperid-4-yl}amino)benzimidazole;
1-(4-Fluorobenzyl)-N-{1-[2-(4-methoxyphenyl)ethyl]piperidin-4-yl}-1H-benzimidazol-2-amine;
Benzimidazole, 1-(p-fluorobenzyl)-2-((1-(2-(p-methoxyphenyl)ethyl)piperid-4-yl)amino)-;
1-[(4-Fluorophenyl)methyl]-N-(1-{2-[4-(methyloxy)phenyl]ethyl}piperidin-4-yl)-1H-benzimidazol-2-amine;
1-[(4-Fluorophenyl)methyl]-N-{1-[2-(4-methoxyphenyl)ethyl]-4-piperidinyl}-1H-benzimidazol-2-amine;
1H-Benzimidazol-2-amine, 1-[(4-fluorophenyl)methyl]-N-{1-[2-(4-methoxyphenyl)ethyl]-4-piperidinyl}-;
1-(4-Fluorobenzyl)-N-[1-(4-methoxyphenethyl)piperidin-4-yl]-1H-benzo[d]imidazol-2-amine

In Other Databases

PubChem 2247
Wikipedia Astemizole
ChemSpider 2160
HMDb HMDB14775
ChEMBL CHEMBL296419
KEGG C06832; D00234
ChemIDPlus 068844779
ChEBI CHEBI:2896
DrugBank APRD00585