U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C16H23N3O2S.ClH
Molecular Weight 357.899
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-Desmethyl almotriptan hydrochloride

SMILES

Cl.CNCCC1=CNC2=CC=C(CS(=O)(=O)N3CCCC3)C=C12

InChI

InChIKey=ZWKMRWOHCAPDCW-UHFFFAOYSA-N
InChI=1S/C16H23N3O2S.ClH/c1-17-7-6-14-11-18-16-5-4-13(10-15(14)16)12-22(20,21)19-8-2-3-9-19;/h4-5,10-11,17-18H,2-3,6-9,12H2,1H3;1H

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
N-Desmethyl almotriptan hydrochloride
Common Name English
Pyrrolidine, 1-[[[3-[2-(methylamino)ethyl]-1H-indol-5-yl]methyl]sulfonyl]-, monohydrochloride
Systematic Name English
1H-Indole-3-ethanamine, N-methyl-5-[(1-pyrrolidinylsulfonyl)methyl]-, hydrochloride (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
9VZ8GB3CQ7
Created by admin on Sat Dec 16 19:29:32 GMT 2023 , Edited by admin on Sat Dec 16 19:29:32 GMT 2023
PRIMARY
PUBCHEM
166451440
Created by admin on Sat Dec 16 19:29:32 GMT 2023 , Edited by admin on Sat Dec 16 19:29:32 GMT 2023
PRIMARY
CAS
154323-50-9
Created by admin on Sat Dec 16 19:29:32 GMT 2023 , Edited by admin on Sat Dec 16 19:29:32 GMT 2023
PRIMARY
PARENT (SALT/SOLVATE)
Structure of N-Desmethyl almotriptan
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966