Identitet

Eletriptan Hydrobromide

Ikke angivet · C22H27BrN2O2S

01Identitet

Lazychem ID	LC-103527
CAS RN	Ikke angivet
PubChem CID	656631
Molecular formula	C22H27BrN2O2S
Molecular weight	463.4 g/mol
IUPAC name	5-[2-(benzenesulfonyl)ethyl]-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole;hydrobromide
InChIKey	UTINOWOSWSPFLJ-FSRHSHDFSA-N

02Struktur og stereokemi

Two-dimensional chemical structure of Eletriptan Hydrobromide — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 4 rings, includes aromatic atoms, includes aliphatic carbon, has 1 defined stereocentre, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres	1
Ring count	4
Secondary amines	0
Tertiary amines	1

SMILES	CN1CCC[C@@H]1CC2=CNC3=C2C=C(C=C3)CCS(=O)(=O)C4=CC=CC=C4.Br
InChI	Ikke angivet

03Stereochemistry

The published structure contains 1 defined and 0 unassigned tetrahedral stereocentre. The exact wedge and dash depiction is shown above.

Defined centres1Structure assigned

Unassigned centres0Structure unspecified

Assignment statusFully assignedExact published identity

Tetrahedral upper bound≤ 2Before symmetry reduction

Published same-connectivity configurations

1 record

These records have the same connectivity, molecular formula and protonation layer, but a different complete InChIKey stereochemical layer. Only separately structure-linked records are shown.