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Molecule : PIQ

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C13H12N4/c1-17-11-7-10(9-5-3-2-4-6-9)8-15-12(11)16-13(17)14/h2-8H,1H3,(H2,14,15,16)
2	InChIKey	InChI	1.03	UQVKZNNCIHJZLS-UHFFFAOYSA-N
3	SMILES	ACDLabs	10.04	n1cc(cc2c1nc(n2C)N)c3ccccc3
4	SMILES	CACTVS	3.341	Cn1c(N)nc2ncc(cc12)c3ccccc3
5	SMILES	OpenEye OEToolkits	1.5.0	Cn1c2cc(cnc2nc1N)c3ccccc3
6	Canonical SMILES	CACTVS	3.341	Cn1c(N)nc2ncc(cc12)c3ccccc3
7	Canonical SMILES	OpenEye OEToolkits	1.5.0	Cn1c2cc(cnc2nc1N)c3ccccc3