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Molecule : ULZ

Encodings of molecule in descriptor strings

Record	Name	Program	Version	Name
1	InChI	InChI	1.03	InChI=1S/C18H19BrN4O/c19-14-2-4-17-16(11-14)13(12-21-17)1-3-15-5-6-20-18(22-15)23-7-9-24-10-8-23/h2,4-6,11-12,21H,1,3,7-10H2
2	InChIKey	InChI	1.03	LPEIQZYVQYBIQO-UHFFFAOYSA-N
3	SMILES	CACTVS	3.385	Brc1ccc2[nH]cc(CCc3ccnc(n3)N4CCOCC4)c2c1
4	SMILES	OpenEye OEToolkits	2.0.7	c1cc2c(cc1Br)c(c[nH]2)CCc3ccnc(n3)N4CCOCC4
5	Canonical SMILES	CACTVS	3.385	Brc1ccc2[nH]cc(CCc3ccnc(n3)N4CCOCC4)c2c1
6	Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cc2c(cc1Br)c(c[nH]2)CCc3ccnc(n3)N4CCOCC4