3,7-Dihydro-1,3-dimethyl-7-[3-[(phenylmethyl)amino]propyl]-1H-purine-2,6-dione

CAS Registry Number®

24890-70-8

CAS Name

3,7-Dihydro-1,3-dimethyl-7-[3-[(phenylmethyl)amino]propyl]-1H-purine-2,6-dione

Molecular Formula

C17H21N5O2

Molecular Mass

327.38

Cite this Page

3,7-Dihydro-1,3-dimethyl-7-[3-[(phenylmethyl)amino]propyl]-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=24890-70-8 (retrieved 2025-01-02) (CAS RN: 24890-70-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H21N5O2/c1-20-15-14(16(23)21(2)17(20)24)22(12-19-15)10-6-9-18-11-13-7-4-3-5-8-13/h3-5,7-8,12,18H,6,9-11H2,1-2H3

InChIKey

InChIKey=OVKWXBYMGXFCRZ-UHFFFAOYSA-N

SMILES

C(CCNCC1=CC=CC=C1)N2C3=C(N(C)C(=O)N(C)C3=O)N=C2

Canonical SMILES

O=C1C2=C(N=CN2CCCNCC=3C=CC=CC3)N(C(=O)N1C)C

Other Names for this Substance

  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-[3-[(phenylmethyl)amino]propyl]-
  • Theophylline, 7-[3-(benzylamino)propyl]-
  • 3,7-Dihydro-1,3-dimethyl-7-[3-[(phenylmethyl)amino]propyl]-1H-purine-2,6-dione
  • 7-(N-Benzyl-3-aminopropyl)theophylline
  • 7-(γ-Benzylaminopropyl)theophylline

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