PP2 (Q7120082)

172889-27-9 (English)

8 October 2016

chemical formula

C₁₅H₁₆ClN₅

1 reference

172889-27-9 (English)

8 October 2016

canonical SMILES

CC(C)(C)N1C2=C(C(=N1)C3=CC=C(C=C3)Cl)C(=NC=N2)N

1 reference

172889-27-9 (English)

InChI=1S/C15H16ClN5/c1-15(2,3)21-14-11(13(17)18-8-19-14)12(20-21)9-4-6-10(16)7-5-9/h4-8H,1-3H3,(H2,17,18,19)

8 October 2016

Identifiers

InChI

1 reference

172889-27-9 (English)

PBBRWFOVCUAONR-UHFFFAOYSA-N

8 October 2016

InChIKey

2 references

172889-27-9 (English)

imported from Wikimedia project

8 October 2016

stated in

ChEBI release 2020-09-01

CAS Registry Number

172889-27-9

2 references

English Wikipedia

InChIKey

PBBRWFOVCUAONR-UHFFFAOYSA-N

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=172889-27-9

1 reference

1-tert-butyl-3-(4-chlorophenyl)-1h-pyrazolo[3,4-d]pyrimidin-4-amine (English)

8 October 2016

1 reference

172889-27-9 (English)

8 October 2016

Reaxys registry number

9409964

1 reference

PP2 (English)

8 October 2016

mapping relation type

1 reference

PP2 (English)

8 October 2016

1 reference

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

CHEMBL406845 (English)

8 October 2016

1 reference

inferred from InChIKey

1 reference

1 reference

DSSTOX compound identifier

DTXCID30225926

0 references

Guide to Pharmacology Ligand ID

9404

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY