Sumatriptan

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Systematic / IUPAC Name: 1-{3-[2-(Dimethylamino)ethyl]-1H-indol-5-yl}-N-methylmethanesulfonamide

ID: Reference2193

Other Names: Sumatran;
Sumax;
Sumatriptanum;
Imitrex oral;
3-[2-(Dimethylamino)ethyl]-N-methylindole-5-methanesulfonamide ; more

Formula: C14H21N3O2S

Class: Therapeutics/Prescription Drugs Sports Doping Drugs

Spectral Data

Sumatriptan mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 45
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/4/2015 2:15:10 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C14H21N3O2S/c1-15-20(18,19)10-11-4-5-14-13(8-11)12(9-16-14)6-7-17(2)3/h4-5,8-9,15-16H,6-7,10H2,1-3H3
InChI Key KQKPFRSPSRPDEB-UHFFFAOYSA-N
Canonical SMILES CNS(=O)(=O)CC1=CC2=C(C=C1)NC=C2CCN(C)C
CAS 103628462
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Other Names Sumatran;
Sumax;
Sumatriptanum;
Imitrex oral;
3-[2-(Dimethylamino)ethyl]-N-methylindole-5-methanesulfonamide;
1-[3-(2-Dimethylaminoethyl)-1H-indol-5-yl]-N-methylmethanesulfonamide;
1H-Indole-5-methanesulfonamide, 3-(2-(dimethylamino)ethyl)-N-methyl-;
Imigrane;
Alsuma;
(3-[2-(Dimethylamino)ethyl]-1H-indol-5-yl)-N-methylmethanesulfonamide;
Migraneitor;
Adracon;
Apigrane;
Illument;
Migralgin;
Sapphirex;
Zecuity;
Altaxa;
Frimig;
Imigen;
Nazdav;
Youshu;
Cinie;
3-[2-(Dimethylamino)ethyl]-N-methyl-1H-indole-5-methanesulfonamide;
1H-Indole-5-methanesulfonamide, 3-[2-(dimethylamino)ethyl]-N-methyl-

In Other Databases

ChEBI CHEBI:10650
Wikipedia Sumatriptan
DrugBank DB00669
PubChem 5358
HMDb HMDB05037
ChemIDPlus 103628462
ChEMBL CHEMBL128
KEGG C07319; D00451
ChemSpider 5165