Chemical identity

2-(4-Methanesulfonylphenyl)-1-pyridin-3-ylethanone

CAS 40061-50-5 · C14H13NO3S

01Identity

Identifiers and names for this exact compound. Empty fields are left unassigned.

Lazychem IDLC-01654
PubChem CID9817004
Name2-(4-Methanesulfonylphenyl)-1-pyridin-3-ylethanone
CAS RN40061-50-5
Molecular formulaC14H13NO3S
Molecular weight275.32 g/mol
IUPAC name2-(4-Methanesulfonylphenyl)-1-pyridin-3-ylethanone
InChIKeyDWKAGCAGFPGSQM-UHFFFAOYSA-N

02Structure identifiers

2D structurePubChem CID 9817004
2D structure: 2-(4-Methanesulfonylphenyl)-1-pyridin-3-ylethanone, CAS 40061-50-5
Structure of 2-(4-Methanesulfonylphenyl)-1-pyridin-3-ylethanone (CAS 40061-50-5). LazyChem record. Source identity: PubChem CID 9817004. Confirm the identifiers before analytical use.Download structure image

Structure facts for this exact identity.

Molecular formulaC14H13NO3S
InChIKeyDWKAGCAGFPGSQM-UHFFFAOYSA-N
Ring count2
Defined stereocentres0
Unassigned stereocentres0
SMILESCS(=O)(=O)C1=CC=C(C=C1)CC(=O)C2=CN=CC=C2
InChIInChI=1S/C14H13NO3S/c1-19(17,18)13-6-4-11(5-7-13)9-14(16)12-3-2-8-15-10-12/h2-8,10H,9H2,1H3

03India status for this compound

These results apply only to this exact compound name and CAS number. Confirm the current official instruments before making a regulatory decision.

NDPS / RCSNOT FOUND IN REVIEWED ENTRIESCAS 40061-50-5 was not found in the reviewed exact-identity entries. Generic, class, analogue, salt and isomer provisions were not evaluated.
SCOMETNOT FOUND IN REVIEWED CAS ENTRIESCAS 40061-50-5 was not found in the reviewed exact-CAS mapping. Generic and analogue entries were not evaluated.

04Names and relationships

Associated parent compound

Etoricoxib

View API and impurity family

Other names

  • 2-(4-(Methylsulfonyl)phenyl)-1-(pyridin-3yl)ethan-1-one2-[4-(Methylsulfonyl)phenyl]-1-(3pyridinyl)ethanone
  • 2-(4(Methylsulfonyl)phenyl)-1-(pyridin-3yl)ethanone
  • 2-(4-(Methylsulfonyl)phenyl)-1-(pyridin-3-yl)ethan-1-one
  • 2-[4-(Methylsulfonyl)phenyl]-1-(3-pyridinyl)ethanone
  • 2-(4-(Methylsulfonyl)phenyl)-1-(pyridin-3-yl)ethanone

Related records from the same parent family

05Documented history

Dated discovery, occurrence, use and issue claims are published only when a suitable primary or government source is available.

No dated history available

No verified discovery, first report, occurrence, use or issue event is currently available for this identity.

06Sources