7-[(2-Chloro-6-fluorophenyl)methyl]-8-(3,5-dimethyl-1H-pyrazol-1-yl)-3,7-dihydro-3-methyl-1H-purine-2,6-dione

CAS Registry Number®

1019100-14-1
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CAS Name

7-[(2-Chloro-6-fluorophenyl)methyl]-8-(3,5-dimethyl-1H-pyrazol-1-yl)-3,7-dihydro-3-methyl-1H-purine-2,6-dione

Molecular Formula

C18H16ClFN6O2

Molecular Mass

402.81

Cite this Page

7-[(2-Chloro-6-fluorophenyl)methyl]-8-(3,5-dimethyl-1H-pyrazol-1-yl)-3,7-dihydro-3-methyl-1H-purine-2,6-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1019100-14-1 (retrieved 2024-09-05) (CAS RN: 1019100-14-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H16ClFN6O2/c1-9-7-10(2)26(23-9)17-21-15-14(16(27)22-18(28)24(15)3)25(17)8-11-12(19)5-4-6-13(11)20/h4-7H,8H2,1-3H3,(H,22,27,28)

InChIKey

InChIKey=JMCWOBQXRVAYEZ-UHFFFAOYSA-N

SMILES

C(N1C(=NC2=C1C(=O)NC(=O)N2C)N3C(C)=CC(C)=N3)C4=C(Cl)C=CC=C4F

Canonical SMILES

O=C1NC(=O)N(C=2N=C(N3N=C(C=C3C)C)N(C12)CC=4C(F)=CC=CC4Cl)C

Other Names for this Substance

  • 1H-Purine-2,6-dione, 7-[(2-chloro-6-fluorophenyl)methyl]-8-(3,5-dimethyl-1H-pyrazol-1-yl)-3,7-dihydro-3-methyl-
  • 7-[(2-Chloro-6-fluorophenyl)methyl]-8-(3,5-dimethyl-1H-pyrazol-1-yl)-3,7-dihydro-3-methyl-1H-purine-2,6-dione