SKO

N'-[6-[2-(6-AZANYL-4-METHYL-PYRIDIN-2-YL)ETHYL]PYRIDIN-2-YL]-N,N'-DIMETHYL-ETHANE-1,2-DIAMINE

Created:	2015-03-22
Last modified:	2015-06-24

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2 entries where SKO is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	47
Chiral Atom Count	0
Bond Count	48
Aromatic Bond Count	12

2D diagram of SKO

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Chemical Component Summary
Name	N'-[6-[2-(6-AZANYL-4-METHYL-PYRIDIN-2-YL)ETHYL]PYRIDIN-2-YL]-N,N'-DIMETHYL-ETHANE-1,2-DIAMINE
Systematic Name (OpenEye OEToolkits)	N'-[6-[2-(6-azanyl-4-methyl-pyridin-2-yl)ethyl]pyridin-2-yl]-N,N'-dimethyl-ethane-1,2-diamine
Formula	C₁₇ H₂₅ N₅
Molecular Weight	299.414
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CNCCN(C)c1cccc(CCc2cc(C)cc(N)n2)n1
SMILES	OpenEye OEToolkits	1.7.6	Cc1cc(nc(c1)N)CCc2cccc(n2)N(C)CCNC
Canonical SMILES	CACTVS	3.385	CNCCN(C)c1cccc(CCc2cc(C)cc(N)n2)n1
Canonical SMILES	OpenEye OEToolkits	1.7.6	Cc1cc(nc(c1)N)CCc2cccc(n2)N(C)CCNC
InChI	InChI	1.03	InChI=1S/C17H25N5/c1-13-11-15(20-16(18)12-13)8-7-14-5-4-6-17(21-14)22(3)10-9-19-2/h4-6,11-12,19H,7-10H2,1-3H3,(H2,18,20)
InChIKey	InChI	1.03	AVQUEPVPLWZPMB-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
Pharos	CHEMBL3586660
PubChem	91808025
ChEMBL	CHEMBL3586660

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.