N-butyl-3-{[6-(9H-purin-6-ylamino)hexanoyl]amino}benzamide (Q27097012)

CHEMBL521105 (English)

19 October 2016

chemical formula

C₂₂H₂₉N₇O₂

1 reference

CHEMBL521105 (English)

19 October 2016

canonical SMILES

CCCCNC(=O)C1=CC(=CC=C1)NC(=O)CCCCCNC2=NC=NC3=C2NC=N3

1 reference

CHEMBL521105 (English)

InChI=1S/C22H29N7O2/c1-2-3-11-24-22(31)16-8-7-9-17(13-16)29-18(30)10-5-4-6-12-23-20-19-21(26-14-25-19)28-15-27-20/h7-9,13-15H,2-6,10-12H2,1H3,(H,24,31)(H,29,30)(H2,23,25,26,27,28)

19 October 2016

Identifiers

InChI

1 reference

CHEMBL521105 (English)

WOYITRCGMUXUDE-UHFFFAOYSA-N

19 October 2016

InChIKey

1 reference

CHEMBL521105 (English)

19 October 2016

1 reference

N-Butyl-3-{[6-(3H-purin-6-ylamino)hexanoyl]amino}benzamide (English)

19 October 2016

2 references

CHEMBL521105 (English)

matched by identifier from

19 October 2016

InChIKey

WOYITRCGMUXUDE-UHFFFAOYSA-N

1 reference

matched by identifier from

CHEMBL521105 (English)

19 October 2016

1 reference

1 reference

InChIKey

WOYITRCGMUXUDE-UHFFFAOYSA-N

0 references

0 references

1 reference

3DAJ (English)