4-(4-Chlorophenyl)-6-(phenylthio)-2-(3-pyridinyl)-5-pyrimidinecarbonitrile

CAS Registry Number®

320418-64-2
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CAS Name

4-(4-Chlorophenyl)-6-(phenylthio)-2-(3-pyridinyl)-5-pyrimidinecarbonitrile

Molecular Formula

C22H13ClN4S

Molecular Mass

400.88

Cite this Page

4-(4-Chlorophenyl)-6-(phenylthio)-2-(3-pyridinyl)-5-pyrimidinecarbonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=320418-64-2 (retrieved 2024-07-07) (CAS RN: 320418-64-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H13ClN4S/c23-17-10-8-15(9-11-17)20-19(13-24)22(28-18-6-2-1-3-7-18)27-21(26-20)16-5-4-12-25-14-16/h1-12,14H

InChIKey

InChIKey=XQYUFHOODGQKMV-UHFFFAOYSA-N

SMILES

C(#N)C=1C(=NC(=NC1SC2=CC=CC=C2)C=3C=CC=NC3)C4=CC=C(Cl)C=C4

Canonical SMILES

N#CC1=C(N=C(N=C1C=2C=CC(Cl)=CC2)C3=CN=CC=C3)SC=4C=CC=CC4

Other Names for this Substance

  • 5-Pyrimidinecarbonitrile, 4-(4-chlorophenyl)-6-(phenylthio)-2-(3-pyridinyl)-
  • 4-(4-Chlorophenyl)-6-(phenylthio)-2-(3-pyridinyl)-5-pyrimidinecarbonitrile