S6T

pretilachlor

Created:	2020-11-10
Last modified:	2024-09-27

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1 entries where S6T is found as a standalone ligand1 entries where S6T is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	47
Chiral Atom Count	0
Bond Count	47
Aromatic Bond Count	6

2D diagram of S6T

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Chemical Component Summary
Name	pretilachlor
Synonyms	2-chloranyl-~{N}-(2,6-diethylphenyl)-~{N}-(2-propoxyethyl)ethanamide; 2-chloro-N-(2,6-diethylphenyl)-N-(2-propoxyethyl)acetamide
Systematic Name (OpenEye OEToolkits)	2-chloranyl-~{N}-(2,6-diethylphenyl)-~{N}-(2-propoxyethyl)ethanamide
Formula	C₁₇ H₂₆ Cl N O₂
Molecular Weight	311.847
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CCCOCCN(C(=O)CCl)c1c(CC)cccc1CC
SMILES	OpenEye OEToolkits	2.0.7	CCCOCCN(c1c(cccc1CC)CC)C(=O)CCl
Canonical SMILES	CACTVS	3.385	CCCOCCN(C(=O)CCl)c1c(CC)cccc1CC
Canonical SMILES	OpenEye OEToolkits	2.0.7	CCCOCCN(c1c(cccc1CC)CC)C(=O)CCl
InChI	InChI	1.03	InChI=1S/C17H26ClNO2/c1-4-11-21-12-10-19(16(20)13-18)17-14(5-2)8-7-9-15(17)6-3/h7-9H,4-6,10-13H2,1-3H3
InChIKey	InChI	1.03	YLPGTOIOYRQOHV-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	91644
ChEMBL	CHEMBL1867271
ChEBI	CHEBI:34931

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