Identita

Niraparib Tosylate

Neuvedeno · C26H28N4O4S

01Identita

Lazychem ID	LC-55473
CAS RN	Neuvedeno
PubChem CID	78357761
Molecular formula	C26H28N4O4S
Molecular weight	492.6 g/mol
IUPAC name	4-methylbenzenesulfonic acid;2-[4-[(3S)-piperidin-3-yl]phenyl]indazole-7-carboxamide
InChIKey	LCPFHXWLJMNKNC-PFEQFJNWSA-N

02Struktura a stereochemie

Two-dimensional chemical structure of Niraparib Tosylate — 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. These statements are calculated from the published structure string.

Defined stereocentres	1
Ring count	5
Secondary amines	1
Tertiary amines	0

SMILES	CC1=CC=C(C=C1)S(=O)(=O)O.C1C[C@H](CNC1)C2=CC=C(C=C2)N3C=C4C=CC=C(C4=N3)C(=O)N
InChI	Neuvedeno

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.