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Molecule : LE3

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C6H13NOS2/c1-10(8)5-3-2-4-7-6-9/h6H,2-5H2,1H3,(H,7,9)/t10-/m1/s1
2	InChIKey	InChI	1.03	ZWRKPZDQBQKJAE-SNVBAGLBSA-N
3	SMILES	ACDLabs	12.01	O=S(CCCCNC=S)C
4	SMILES	CACTVS	3.370	C[S](=O)CCCCNC=S
5	SMILES	OpenEye OEToolkits	1.7.2	CS(=O)CCCCNC=S
6	Canonical SMILES	CACTVS	3.370	C[S@@](=O)CCCCNC=S
7	Canonical SMILES	OpenEye OEToolkits	1.7.2	C[S@@](=O)CCCCNC=S