IUZ

2-chloranyl-9-(cyclohexylmethyl)-~{N}-methyl-purin-6-amine

Created:	2023-08-03
Last modified:	2023-12-06

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1 entries where IUZ is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	37
Chiral Atom Count	0
Bond Count	39
Aromatic Bond Count	10

2D diagram of IUZ

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Chemical Component Summary
Name	2-chloranyl-9-(cyclohexylmethyl)-~{N}-methyl-purin-6-amine
Systematic Name (OpenEye OEToolkits)	2-chloranyl-9-(cyclohexylmethyl)-~{N}-methyl-purin-6-amine
Formula	C₁₃ H₁₈ Cl N₅
Molecular Weight	279.769
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CNc1nc(Cl)nc2n(CC3CCCCC3)cnc12
SMILES	OpenEye OEToolkits	2.0.7	CNc1c2c(nc(n1)Cl)n(cn2)CC3CCCCC3
Canonical SMILES	CACTVS	3.385	CNc1nc(Cl)nc2n(CC3CCCCC3)cnc12
Canonical SMILES	OpenEye OEToolkits	2.0.7	CNc1c2c(nc(n1)Cl)n(cn2)CC3CCCCC3
InChI	InChI	1.06	InChI=1S/C13H18ClN5/c1-15-11-10-12(18-13(14)17-11)19(8-16-10)7-9-5-3-2-4-6-9/h8-9H,2-7H2,1H3,(H,15,17,18)
InChIKey	InChI	1.06	FNGVCCDFSOXCFD-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	167889300

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.