2-(Methylthio)-6-[4-[5-[[3-(trifluoromethyl)phenyl]amino]-1H-1,2,4-triazol-3-yl]phenoxy]-4-pyrimidinamine

CAS Registry Number®

877874-85-6

CAS Name

2-(Methylthio)-6-[4-[5-[[3-(trifluoromethyl)phenyl]amino]-1H-1,2,4-triazol-3-yl]phenoxy]-4-pyrimidinamine

Molecular Formula

C20H16F3N7OS

Molecular Mass

459.45

Cite this Page

2-(Methylthio)-6-[4-[5-[[3-(trifluoromethyl)phenyl]amino]-1H-1,2,4-triazol-3-yl]phenoxy]-4-pyrimidinamine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=877874-85-6 (retrieved 2024-11-27) (CAS RN: 877874-85-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H16F3N7OS/c1-32-19-26-15(24)10-16(27-19)31-14-7-5-11(6-8-14)17-28-18(30-29-17)25-13-4-2-3-12(9-13)20(21,22)23/h2-10H,1H3,(H2,24,26,27)(H2,25,28,29,30)

InChIKey

InChIKey=CMYHZFCJPORPHY-UHFFFAOYSA-N

SMILES

N(C=1NC(=NN1)C2=CC=C(OC3=NC(SC)=NC(N)=C3)C=C2)C4=CC(C(F)(F)F)=CC=C4

Canonical SMILES

FC(F)(F)C=1C=CC=C(C1)NC2=NN=C(N2)C=3C=CC(OC4=NC(=NC(N)=C4)SC)=CC3

Other Names for this Substance

  • 4-Pyrimidinamine, 2-(methylthio)-6-[4-[5-[[3-(trifluoromethyl)phenyl]amino]-1H-1,2,4-triazol-3-yl]phenoxy]-
  • 2-(Methylthio)-6-[4-[5-[[3-(trifluoromethyl)phenyl]amino]-1H-1,2,4-triazol-3-yl]phenoxy]-4-pyrimidinamine
  • 2-(Methylthio)-6-[4-[5-[[3-(trifluoromethyl)phenyl]amino]-4H-1,2,4-triazol-3-yl]phenoxy]pyrimidin-4-amine

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