CHEBI:31409 - Clemizole hydrochloride

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ChEBI Name Clemizole hydrochloride ChEBI ID CHEBI:31409 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formulae C19H21Cl2N3 C19H21ClN3.Cl Net Charge 0 Average Mass 362.297 Monoisotopic Mass 361.11125 InChI InChI=1S/C19H20ClN3.ClH/c20-16-9-7-15(8-10-16)13-23-18-6-2-1-5-17(18)21-19(23)14-22-11-3-4-12-22;/h1-2,5-10H,3-4,11-14H2;1H InChIKey DNFMJYXRIMLMBZ-UHFFFAOYSA-N SMILES C1=CC2=C(C=C1)N(C(=N2)CN3CCCC3)CC4=CC=C(C=C4)Cl.Cl ChEBI Ontology Outgoing Clemizole hydrochloride (CHEBI:31409) is a benzimidazoles (CHEBI:22715) Synonyms Sources Allercur KEGG COMPOUND Clemizole hydrochloride KEGG COMPOUND Reactrol KEGG COMPOUND Manual Xref Database D01705 KEGG DRUG View more database links Registry Number Type Source 1163-36-6 CAS Registry Number KEGG COMPOUND Last Modified 06 March 2017