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Details

Stereochemistry RACEMIC
Molecular Formula C27H36N2O5
Molecular Weight 468.5851
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IVABRADINE, (±)-

SMILES

COC1=C(OC)C=C2C(CN(C)CCCN3CCC4=CC(OC)=C(OC)C=C4CC3=O)CC2=C1

InChI

InChIKey=ACRHBAYQBXXRTO-UHFFFAOYSA-N
InChI=1S/C27H36N2O5/c1-28(17-21-11-20-14-25(33-4)26(34-5)16-22(20)21)8-6-9-29-10-7-18-12-23(31-2)24(32-3)13-19(18)15-27(29)30/h12-14,16,21H,6-11,15,17H2,1-5H3

HIDE SMILES / InChI

Approval Year

Name Type Language
IVABRADINE, (±)-
Common Name English
S-15544
Code English
IVABRADINE (±)-FORM [MI]
Common Name English
2H-3-BENZAZEPIN-2-ONE, 3-(3-(((3,4-DIMETHOXYBICYCLO(4.2.0)OCTA-1,3,5-TRIEN-7-YL)METHYL)METHYLAMINO)PROPYL)-1,3,4,5-TETRAHYDRO-7,8-DIMETHOXY-
Systematic Name English
Code System Code Type Description
CAS
148870-59-1
Created by admin on Sat Dec 16 10:00:04 GMT 2023 , Edited by admin on Sat Dec 16 10:00:04 GMT 2023
PRIMARY
MERCK INDEX
m6564
Created by admin on Sat Dec 16 10:00:04 GMT 2023 , Edited by admin on Sat Dec 16 10:00:04 GMT 2023
PRIMARY Merck Index
PUBCHEM
6426711
Created by admin on Sat Dec 16 10:00:04 GMT 2023 , Edited by admin on Sat Dec 16 10:00:04 GMT 2023
PRIMARY
FDA UNII
C8ADC441ME
Created by admin on Sat Dec 16 10:00:04 GMT 2023 , Edited by admin on Sat Dec 16 10:00:04 GMT 2023
PRIMARY