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Molecule : 5SK

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C14H17N5/c1-4-9(2)15-13-14-18-17-10(3)19(14)12-8-6-5-7-11(12)16-13/h5-9H,4H2,1-3H3,(H,15,16)/t9-/m1/s1
2	InChIKey	InChI	1.03	NPOOPJOEQAWGNZ-SECBINFHSA-N
3	SMILES	CACTVS	3.385	CC[CH](C)Nc1nc2ccccc2n3c(C)nnc13
4	SMILES	OpenEye OEToolkits	2.0.4	CCC(C)Nc1c2nnc(n2c3ccccc3n1)C
5	Canonical SMILES	CACTVS	3.385	CC[C@@H](C)Nc1nc2ccccc2n3c(C)nnc13
6	Canonical SMILES	OpenEye OEToolkits	2.0.4	CC[C@@H](C)Nc1c2nnc(n2c3ccccc3n1)C