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Technical details about Etripamil, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: 1593673-23-4, Msp-2017, (-)-msp-2017, Ms)-msp-2017, S82a18y42p, Methyl (s)-3-(2-((4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl)(methyl)amino)ethyl)benzoate
Molecular Formula
C27H36N2O4
Molecular Weight
452.6  g/mol
InChI Key
VAZNEHLGJGSQEL-MHZLTWQESA-N
FDA UNII
S82A18Y42P

Etripamil has been used in trials studying the treatment of Paroxysmal Supraventricular Tachycardia (PSVT).
1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
methyl 3-[2-[[(4S)-4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl]-methylamino]ethyl]benzoate
2.1.2 InChI
InChI=1S/C27H36N2O4/c1-20(2)27(19-28,23-11-12-24(31-4)25(18-23)32-5)14-8-15-29(3)16-13-21-9-7-10-22(17-21)26(30)33-6/h7,9-12,17-18,20H,8,13-16H2,1-6H3/t27-/m0/s1
2.1.3 InChI Key
VAZNEHLGJGSQEL-MHZLTWQESA-N
2.1.4 Canonical SMILES
CC(C)C(CCCN(C)CCC1=CC(=CC=C1)C(=O)OC)(C#N)C2=CC(=C(C=C2)OC)OC
2.1.5 Isomeric SMILES
CC(C)[C@](CCCN(C)CCC1=CC(=CC=C1)C(=O)OC)(C#N)C2=CC(=C(C=C2)OC)OC
2.2 Other Identifiers
2.2.1 UNII
S82A18Y42P
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Benzoic Acid, 3-(2-(((4s)-4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl)methylamino)ethyl)-, Methyl Ester

2. Methyl 3-(2-(((4s)-4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl)(methyl)amino)ethyl)benzoate

2.3.2 Depositor-Supplied Synonyms

1. 1593673-23-4

2. Msp-2017

3. (-)-msp-2017

4. Ms)-msp-2017

5. S82a18y42p

6. Methyl (s)-3-(2-((4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl)(methyl)amino)ethyl)benzoate

7. Benzoic Acid, 3-(2-(((4s)-4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl)methylamino)ethyl)- , Methyl Ester

8. Etripamil [usan:inn]

9. Unii-s82a18y42p

10. Etripamil [inn]

11. Etripamil (usan/inn)

12. Etripamil [usan]

13. Etripamil [who-dd]

14. Chembl3707312

15. Ex-a5306

16. Db12605

17. Hy-17611

18. Cs-0014689

19. D10932

20. Q27289030

21. Benzoic Acid, 3-(2-(((4s)-4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl)methylamino)ethyl)-, Methyl Ester

22. Methyl 3-[2-[[(4s)-4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl]-methylamino]ethyl]benzoate

2.4 Create Date
2015-07-27
3 Chemical and Physical Properties
Molecular Weight 452.6 g/mol
Molecular Formula C27H36N2O4
XLogP33.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count13
Exact Mass452.26750763 g/mol
Monoisotopic Mass452.26750763 g/mol
Topological Polar Surface Area71.8 Ų
Heavy Atom Count33
Formal Charge0
Complexity645
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Drug and Medication Information
4.1 Drug Indication

Treatment of supraventricular arrhythmias


5 Pharmacology and Biochemistry
5.1 MeSH Pharmacological Classification

Calcium Channel Blockers

A class of drugs that act by selective inhibition of calcium influx through cellular membranes. (See all compounds classified as Calcium Channel Blockers.)


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