Идентичност

Dalilesen Impurity 5

Не е посочено · C23H23ClN6O3

01Идентичност

Lazychem ID	LC-36211
CAS RN	Не е посочено
PubChem CID	118127062
Molecular formula	C23H23ClN6O3
Molecular weight	466.9 g/mol
IUPAC name	[5-chloro-2-(triazol-2-yl)phenyl]-[(2S)-2-(5,6-dimethoxy-1H-benzimidazol-2-yl)-2-methylpyrrolidin-1-yl]methanone
InChIKey	WRTMDRWKXMIWFX-QHCPKHFHSA-N

02Структура и стереохимия

Two-dimensional chemical structure of Dalilesen Impurity 5 — Two-dimensional structure for the PubChem identity linked to this record. Confirm the identifiers before analytical use.

The parsed structure contains 5 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	5
Secondary amines	0
Tertiary amines	0

SMILES	C[C@]1(CCCN1C(=O)C2=C(C=CC(=C2)Cl)N3N=CC=N3)C4=NC5=CC(=C(C=C5N4)OC)OC
InChI	Не е посочено

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.