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Molecule : D6X

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C18H18N6/c1-12-11-13(2)24-18(20-12)22-17(23-24)9-10-19-16-8-7-14-5-3-4-6-15(14)21-16/h3-8,11H,9-10H2,1-2H3,(H,19,21)
2	InChIKey	InChI	1.03	GAAIMHFFJZPUGG-UHFFFAOYSA-N
3	SMILES	CACTVS	3.385	Cc1cc(C)n2nc(CCNc3ccc4ccccc4n3)nc2n1
4	SMILES	OpenEye OEToolkits	2.0.7	Cc1cc(n2c(n1)nc(n2)CCNc3ccc4ccccc4n3)C
5	Canonical SMILES	CACTVS	3.385	Cc1cc(C)n2nc(CCNc3ccc4ccccc4n3)nc2n1
6	Canonical SMILES	OpenEye OEToolkits	2.0.7	Cc1cc(n2c(n1)nc(n2)CCNc3ccc4ccccc4n3)C