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Molecule : IQW

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C13H13N5/c1-7-2-4-8(5-3-7)9-6-16-12-10(9)11(14)17-13(15)18-12/h2-6H,1H3,(H5,14,15,16,17,18)
2	InChIKey	InChI	1.03	OKAZKDKAGZDUKA-UHFFFAOYSA-N
3	SMILES	ACDLabs	12.01	n1c(c2c(nc1N)ncc2c3ccc(cc3)C)N
4	SMILES	CACTVS	3.385	Cc1ccc(cc1)c2c[nH]c3nc(N)nc(N)c23
5	SMILES	OpenEye OEToolkits	1.7.6	Cc1ccc(cc1)c2c[nH]c3c2c(nc(n3)N)N
6	Canonical SMILES	CACTVS	3.385	Cc1ccc(cc1)c2c[nH]c3nc(N)nc(N)c23
7	Canonical SMILES	OpenEye OEToolkits	1.7.6	Cc1ccc(cc1)c2c[nH]c3c2c(nc(n3)N)N