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Molecule : JR2

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C10H13N5/c11-10-13-8-7(3-4-12-8)9(14-10)15-5-1-2-6-15/h3-4H,1-2,5-6H2,(H3,11,12,13,14)
2	InChIKey	InChI	1.03	AZLCKCSXUACTMA-UHFFFAOYSA-N
3	SMILES	ACDLabs	12.01	n1c(nc(c2ccnc12)N3CCCC3)N
4	SMILES	CACTVS	3.385	Nc1nc2[nH]ccc2c(n1)N3CCCC3
5	SMILES	OpenEye OEToolkits	1.7.6	c1c[nH]c2c1c(nc(n2)N)N3CCCC3
6	Canonical SMILES	CACTVS	3.385	Nc1nc2[nH]ccc2c(n1)N3CCCC3
7	Canonical SMILES	OpenEye OEToolkits	1.7.6	c1c[nH]c2c1c(nc(n2)N)N3CCCC3