REG

1-cyclopentyl-3-[[(2~{S})-oxolan-2-yl]methyl]urea

Created:	2020-02-10
Last modified:	2020-06-03

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4 entries where REG is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	35
Chiral Atom Count	1
Bond Count	36
Aromatic Bond Count	0

2D diagram of REG

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Chemical Component Summary
Name	1-cyclopentyl-3-[[(2~{S})-oxolan-2-yl]methyl]urea
Systematic Name (OpenEye OEToolkits)	1-cyclopentyl-3-[[(2~{S})-oxolan-2-yl]methyl]urea
Formula	C₁₁ H₂₀ N₂ O₂
Molecular Weight	212.289
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	O=C(NC[CH]1CCCO1)NC2CCCC2
SMILES	OpenEye OEToolkits	2.0.6	C1CCC(C1)NC(=O)NCC2CCCO2
Canonical SMILES	CACTVS	3.385	O=C(NC[C@@H]1CCCO1)NC2CCCC2
Canonical SMILES	OpenEye OEToolkits	2.0.6	C1CCC(C1)NC(=O)NC[C@@H]2CCCO2
InChI	InChI	1.03	InChI=1S/C11H20N2O2/c14-11(13-9-4-1-2-5-9)12-8-10-6-3-7-15-10/h9-10H,1-8H2,(H2,12,13,14)/t10-/m0/s1
InChIKey	InChI	1.03	GZCFMEFTVSKHDE-JTQLQIEISA-N

Related Resource References

Resource Name	Reference
PubChem	38154782

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