6-[(Phenylmethyl)thio]-9H-purine

CAS Registry Number®

724-34-5

CAS Name

6-[(Phenylmethyl)thio]-9H-purine

Molecular Formula

C12H10N4S

Molecular Mass

242.30

Cite this Page

6-[(Phenylmethyl)thio]-9H-purine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=724-34-5 (retrieved 2024-12-23) (CAS RN: 724-34-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    188-189 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H10N4S/c1-2-4-9(5-3-1)6-17-12-10-11(14-7-13-10)15-8-16-12/h1-5,7-8H,6H2,(H,13,14,15,16)

InChIKey

InChIKey=ULIQGBPQLPCTAJ-UHFFFAOYSA-N

SMILES

S(CC1=CC=CC=C1)C2=C3C(N=CN3)=NC=N2

Canonical SMILES

N1=CN=C(SCC=2C=CC=CC2)C=3NC=NC13

Other Names for this Substance

  • 9H-Purine, 6-[(phenylmethyl)thio]-
  • Purine, 6-(benzylthio)-
  • 1H-Purine, 6-[(phenylmethyl)thio]-
  • 6-[(Phenylmethyl)thio]-9H-purine
  • 6-(Benzylthio)purine

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