Drug Information

Drug General Information
Drug ID
D01UUW
Former ID
DIB002847
Drug Name
Trecetilide fumarate
Synonyms
PNU-108342E; Trecetilide fumarate < Prop INNM; (-)-N-[4-[4-[N-Ethyl-N-(6-fluoro-6-methylheptyl)amino]-1(S)-hydroxybutyl]phenyl]methanesulfonamide fumarate (2:1)
Drug Type
Small molecular drug
Indication Cardiac arrhythmias [ICD9: 427; ICD10:I47-I49] Investigative [527182], [531635]
Structure
Download
2D MOL

3D MOL
Formula
C25H41FN2O7S
Canonical SMILES
CCN(CCCCCC(C)(C)F)CCC[C@H](O)c1ccc(NS(=O)(=O)C)cc1.OC(=<br />O)\\C=C\\C(=O)O
InChI
1S/C21H37FN2O3S.C4H4O4/c1-5-24(16-8-6-7-15-21(2,3)22)17-9-10-20(25)18-11-13-19(14-12-18)23-28(4,26)27;5-3(6)1-2-4(7)8/h11-14,20,23,25H,5-10,15-17H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t20-;/m0./s1
InChIKey
IRYAEHRTLXOXNY-WNGBCCIYSA-N
CAS Number
CAS 180918-68-7
PubChem Compound ID
9807087
Target and Pathway
Target(s) Potassium channel Target Info Blocker [527182], [531635]
References
Ref 527182IKr channel blockers: novel antiarrhythmic agents. Curr Med Chem Cardiovasc Hematol Agents. 2003 Oct;1(3):203-23.
Ref 531635Therapeutic target database update 2012: a resource for facilitating target-oriented drug discovery. Nucleic Acids Res. 2012 Jan;40(Database issue):D1128-36.
Ref 527182IKr channel blockers: novel antiarrhythmic agents. Curr Med Chem Cardiovasc Hematol Agents. 2003 Oct;1(3):203-23.
Ref 531635Therapeutic target database update 2012: a resource for facilitating target-oriented drug discovery. Nucleic Acids Res. 2012 Jan;40(Database issue):D1128-36.

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