Baricitinib

CAS Registry Number®

1187594-09-7

CAS Name

Baricitinib

Molecular Formula

C16H17N7O2S

Molecular Mass

371.42

Cite this Page

Baricitinib.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1187594-09-7 (retrieved 2024-11-21) (CAS RN: 1187594-09-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    193-195 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H17N7O2S/c1-2-26(24,25)22-9-16(10-22,4-5-17)23-8-12(7-21-23)14-13-3-6-18-15(13)20-11-19-14/h3,6-8,11H,2,4,9-10H2,1H3,(H,18,19,20)

InChIKey

InChIKey=XUZMWHLSFXCVMG-UHFFFAOYSA-N

SMILES

C(C#N)C1(CN(S(CC)(=O)=O)C1)N2C=C(C=N2)C3=C4C(=NC=N3)NC=C4

Canonical SMILES

N#CCC1(N2N=CC(=C2)C=3N=CN=C4NC=CC43)CN(C1)S(=O)(=O)CC

Other Names for this Substance

  • 3-Azetidineacetonitrile, 1-(ethylsulfonyl)-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]-
  • 1-(Ethylsulfonyl)-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1H-pyrazol-1-yl]-3-azetidineacetonitrile
  • LY 3009104
  • Baricitinib
  • INCB 028050

View All

Deleted or Replaced CAS Registry Numbers

1231199-29-3, 1374987-77-5

CAS INSIGHTSTM
Targeted protein degrader structure, illustration