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Molecule : K6W

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C18H16N2S/c19-18(20)17-12-15(14-9-5-2-6-10-14)16(21-17)11-13-7-3-1-4-8-13/h1-10,12H,11H2,(H3,19,20)
2	InChIKey	InChI	1.03	NINSVBHVKFSPEZ-UHFFFAOYSA-N
3	SMILES	CACTVS	3.385	NC(=N)c1sc(Cc2ccccc2)c(c1)c3ccccc3
4	SMILES	OpenEye OEToolkits	2.0.7	c1ccc(cc1)Cc2c(cc(s2)C(=N)N)c3ccccc3
5	Canonical SMILES	CACTVS	3.385	NC(=N)c1sc(Cc2ccccc2)c(c1)c3ccccc3
6	Canonical SMILES	OpenEye OEToolkits	2.0.7	[H]/N=C(/c1cc(c(s1)Cc2ccccc2)c3ccccc3)\N