3FH

1-hydroxy-3-(trifluoromethyl)pyridine-2(1H)-thione

Created:	2014-04-29
Last modified:	2015-03-11

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1 entries where 3FH is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	16
Chiral Atom Count	0
Bond Count	16
Aromatic Bond Count	0

2D diagram of 3FH

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Chemical Component Summary
Name	1-hydroxy-3-(trifluoromethyl)pyridine-2(1H)-thione
Systematic Name (OpenEye OEToolkits)	1-oxidanyl-3-(trifluoromethyl)pyridine-2-thione
Formula	C₆ H₄ F₃ N O S
Molecular Weight	195.162
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	S=C1C(=CC=CN1O)C(F)(F)F
SMILES	CACTVS	3.385	ON1C=CC=C(C1=S)C(F)(F)F
SMILES	OpenEye OEToolkits	1.7.6	C1=CN(C(=S)C(=C1)C(F)(F)F)O
Canonical SMILES	CACTVS	3.385	ON1C=CC=C(C1=S)C(F)(F)F
Canonical SMILES	OpenEye OEToolkits	1.7.6	C1=CN(C(=S)C(=C1)C(F)(F)F)O
InChI	InChI	1.03	InChI=1S/C6H4F3NOS/c7-6(8,9)4-2-1-3-10(11)5(4)12/h1-3,11H
InChIKey	InChI	1.03	IILCCFILLZAKJZ-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	91362447
ChEMBL	CHEMBL3326434

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