IZS

ethyl 2-[(4,6-diethylpyrimidin-2-yl)-methyl-amino]ethanoate

Created:	2023-08-04
Last modified:	2024-09-27

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2 entries where IZS is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	39
Chiral Atom Count	0
Bond Count	39
Aromatic Bond Count	6

2D diagram of IZS

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Chemical Component Summary
Name	ethyl 2-[(4,6-diethylpyrimidin-2-yl)-methyl-amino]ethanoate
Systematic Name (OpenEye OEToolkits)	ethyl 2-[(4,6-diethylpyrimidin-2-yl)-methyl-amino]ethanoate
Formula	C₁₃ H₂₁ N₃ O₂
Molecular Weight	251.325
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CCOC(=O)CN(C)c1nc(CC)cc(CC)n1
SMILES	OpenEye OEToolkits	2.0.7	CCc1cc(nc(n1)N(C)CC(=O)OCC)CC
Canonical SMILES	CACTVS	3.385	CCOC(=O)CN(C)c1nc(CC)cc(CC)n1
Canonical SMILES	OpenEye OEToolkits	2.0.7	CCc1cc(nc(n1)N(C)CC(=O)OCC)CC
InChI	InChI	1.06	InChI=1S/C13H21N3O2/c1-5-10-8-11(6-2)15-13(14-10)16(4)9-12(17)18-7-3/h8H,5-7,9H2,1-4H3
InChIKey	InChI	1.06	MVDCBXIEQXAEDI-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	168719757

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