Tapatybė

Remibrutinib Impurity 6

Nenurodyta · C27H27F2N5O4

01Tapatybė

Lazychem ID	LC-36220
CAS RN	Nenurodyta
PubChem CID	118107442
Molecular formula	C27H27F2N5O4
Molecular weight	523.5 g/mol
IUPAC name	N-[2-[4-amino-6-[3-[(4-cyclopropyl-2-fluorobenzoyl)amino]-5-fluoro-2-methylphenyl]pyrimidin-5-yl]oxyethyl]-N-methyloxirane-2-carboxamide
InChIKey	ZFUQKYYJMUPMTI-UHFFFAOYSA-N

02Struktūra ir stereochemija

Two-dimensional chemical structure of Remibrutinib Impurity 6 — 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, contains at least one halogen atom. These statements are calculated from the published structure string.

Defined stereocentres	0
Ring count	5
Secondary amines	0
Tertiary amines	0

SMILES	CC1=C(C=C(C=C1NC(=O)C2=C(C=C(C=C2)C3CC3)F)F)C4=C(C(=NC=N4)N)OCCN(C)C(=O)C5CO5
InChI	Nenurodyta

03Stereochemistry

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

Defined centres0Structure assigned

Unassigned centres1Structure unspecified

Assignment statusUnassignedExact 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.