2,4-Pteridinediamine, 6,7-bis(1-methylethyl)-, phosphate (1:1)

CAS Registry Number®

84176-65-8
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CAS Name

2,4-Pteridinediamine, 6,7-bis(1-methylethyl)-, phosphate (1:1)

Molecular Formula

C12H18N6.H3O4P

Cite this Page

2,4-Pteridinediamine, 6,7-bis(1-methylethyl)-, phosphate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=84176-65-8 (retrieved 2024-07-25) (CAS RN: 84176-65-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H18N6.H3O4P/c1-5(2)7-8(6(3)4)16-11-9(15-7)10(13)17-12(14)18-11;1-5(2,3)4/h5-6H,1-4H3,(H4,13,14,16,17,18);(H3,1,2,3,4)

InChIKey

InChIKey=YNQBQYASRYRNRY-UHFFFAOYSA-N

SMILES

P(=O)(O)(O)O.NC=1C2=C(N=C(C(C)C)C(C(C)C)=N2)N=C(N)N1

Canonical SMILES

O=P(O)(O)O.N=1C(=NC(N)=C2N=C(C(=NC12)C(C)C)C(C)C)N

Other Names for this Substance

  • 2,4-Pteridinediamine, 6,7-bis(1-methylethyl)-, phosphate (1:1)
  • Pteridine, 2,4-diamino-6,7-diisopropyl-, phosphate
  • NSC 98771
  • 2,4-Diamino-6,7-diisopropylpteridine Phosphate