CHEBI:2401 - acetophenazine

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ChEBI Name acetophenazine ChEBI ID CHEBI:2401 Definition A member of the class of phenothiazines that is 10H-phenothiazine substituted by a 3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl group at the nitogen atom and an acetyl group at position 2. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C23H29N3O2S Net Charge 0 Average Mass 411.56138 Monoisotopic Mass 411.19805 InChI InChI=1S/C23H29N3O2S/c1-18(28)19-7-8-23-21(17-19)26(20-5-2-3-6-22(20)29-23)10-4-9-24-11-13-25(14-12-24)15-16-27/h2-3,5-8,17,27H,4,9-16H2,1H3 InChIKey WNTYBHLDCKXEOT-UHFFFAOYSA-N SMILES CC(=O)c1ccc2Sc3ccccc3N(CCCN3CCN(CCO)CC3)c2c1 Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Application(s): phenothiazine antipsychotic drug View more via ChEBI Ontology ChEBI Ontology Outgoing acetophenazine (CHEBI:2401) has functional parent 10H-phenothiazine (CHEBI:37931) acetophenazine (CHEBI:2401) has role phenothiazine antipsychotic drug (CHEBI:37930) acetophenazine (CHEBI:2401) is a N-(2-hydroxyethyl)piperazine (CHEBI:46851) acetophenazine (CHEBI:2401) is a N-alkylpiperazine (CHEBI:46845) acetophenazine (CHEBI:2401) is a phenothiazines (CHEBI:38093) Incoming acetophenazine dimaleate (CHEBI:2402) has part acetophenazine (CHEBI:2401) IUPAC Name 1-(10-{3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl}-10H-phenothiazin-2-yl)ethanone Synonym Source Acetophenazine KEGG COMPOUND Manual Xrefs Databases 59 DrugCentral Acetophenazine Wikipedia C06807 KEGG COMPOUND DB01063 DrugBank HMDB0015196 HMDB View more database links Registry Numbers Types Sources 2751-68-0 CAS Registry Number ChemIDplus 2751-68-0 CAS Registry Number NIST Chemistry WebBook 57631 Beilstein Registry Number Beilstein 57631 Reaxys Registry Number Reaxys Citations Types Sources 13904111 PubMed citation Europe PMC 13986480 PubMed citation Europe PMC 14020672 PubMed citation Europe PMC 14211419 PubMed citation Europe PMC Last Modified 22 February 2017