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Molecule : 72Y

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C14H13Cl2N5/c1-7-5-18-10(8(2)11(7)15)6-21-4-3-9-12(16)19-14(17)20-13(9)21/h3-5H,6H2,1-2H3,(H2,17,19,20)
2	InChIKey	InChI	1.03	UTYKALJIQPGPEY-UHFFFAOYSA-N
3	SMILES	CACTVS	3.385	Cc1cnc(Cn2ccc3c(Cl)nc(N)nc23)c(C)c1Cl
4	SMILES	OpenEye OEToolkits	2.0.5	Cc1cnc(c(c1Cl)C)Cn2ccc3c2nc(nc3Cl)N
5	Canonical SMILES	CACTVS	3.385	Cc1cnc(Cn2ccc3c(Cl)nc(N)nc23)c(C)c1Cl
6	Canonical SMILES	OpenEye OEToolkits	2.0.5	Cc1cnc(c(c1Cl)C)Cn2ccc3c2nc(nc3Cl)N