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Molecule : LEK

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C19H19N3S/c1-3-22-18-7-4-13(10-20-2)8-16(18)15-6-5-14(9-19(15)22)17-11-23-12-21-17/h4-9,11-12,20H,3,10H2,1-2H3
2	InChIKey	InChI	1.03	BYZRRANZUUJGLQ-UHFFFAOYSA-N
3	SMILES	CACTVS	3.385	CCn1c2ccc(CNC)cc2c3ccc(cc13)c4cscn4
4	SMILES	OpenEye OEToolkits	2.0.7	CCn1c2ccc(cc2c3c1cc(cc3)c4cscn4)CNC
5	Canonical SMILES	CACTVS	3.385	CCn1c2ccc(CNC)cc2c3ccc(cc13)c4cscn4
6	Canonical SMILES	OpenEye OEToolkits	2.0.7	CCn1c2ccc(cc2c3c1cc(cc3)c4cscn4)CNC