9-(2,2-Difluoroethyl)-6-[(3,5-difluorophenyl)amino]-9H-purine-2-carbonitrile

CAS Registry Number®

1199523-26-6

CAS Name

9-(2,2-Difluoroethyl)-6-[(3,5-difluorophenyl)amino]-9H-purine-2-carbonitrile

Molecular Formula

C14H8F4N6

Molecular Mass

336.25

Cite this Page

9-(2,2-Difluoroethyl)-6-[(3,5-difluorophenyl)amino]-9H-purine-2-carbonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1199523-26-6 (retrieved 2024-11-23) (CAS RN: 1199523-26-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H8F4N6/c15-7-1-8(16)3-9(2-7)21-13-12-14(23-11(4-19)22-13)24(6-20-12)5-10(17)18/h1-3,6,10H,5H2,(H,21,22,23)

InChIKey

InChIKey=VMJFQUMKCMNFSX-UHFFFAOYSA-N

SMILES

N(C1=C2C(N(CC(F)F)C=N2)=NC(C#N)=N1)C3=CC(F)=CC(F)=C3

Canonical SMILES

N#CC=1N=C(NC=2C=C(F)C=C(F)C2)C=3N=CN(C3N1)CC(F)F

Other Names for this Substance

  • 9H-Purine-2-carbonitrile, 9-(2,2-difluoroethyl)-6-[(3,5-difluorophenyl)amino]-
  • 9-(2,2-Difluoroethyl)-6-[(3,5-difluorophenyl)amino]-9H-purine-2-carbonitrile

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