Ibutilide fumarate
CAS Registry Number®
122647-32-9
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CAS Name
Ibutilide fumarateMolecular Formula
C20H36N2O3S.1/2C4H4O4Cite this Page
Ibutilide fumarate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=122647-32-9 (retrieved ) (CAS RN: 122647-32-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
117-119 °C
Source(s)
- (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)
Other Names and Identifiers
InChI
InChI=1S/C20H36N2O3S.C4H4O4/c1-4-6-7-8-9-16-22(5-2)17-10-11-20(23)18-12-14-19(15-13-18)21-26(3,24)25;5-3(6)1-2-4(7)8/h12-15,20-21,23H,4-11,16-17H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
InChIKey
InChIKey=PAXBPNBQGZYWHP-WLHGVMLRSA-N
SMILES
C(CCCN(CCCCCCC)CC)(O)C1=CC=C(NS(C)(=O)=O)C=C1.C(=C/C(O)=O)\C(O)=O
Canonical SMILES
O=C(O)C=CC(=O)O.O=S(=O)(NC1=CC=C(C=C1)C(O)CCCN(CC)CCCCCCC)C
Other Names for this Substance
- Methanesulfonamide, N-[4-[4-(ethylheptylamino)-1-hydroxybutyl]phenyl]-, (2E)-2-butenedioate (2:1)
- Methanesulfonamide, N-[4-[4-(ethylheptylamino)-1-hydroxybutyl]phenyl]-, (±)-, (E)-2-butenedioate (2:1) (salt)
- Methanesulfonamide, N-[4-[4-(ethylheptylamino)-1-hydroxybutyl]phenyl]-, (2E)-2-butenedioate (2:1) (salt)
- U 70226E
- Ibutilide fumarate
Deleted or Replaced CAS Registry Numbers
130350-52-6
