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3-[3-[butyl-(5-ethylpyrimidin-2-yl)amino]propoxy]quinoxaline-2-carboxylic acid
3-[3-[butyl-(5-ethylpyrimidin-2-yl)amino]propoxy]quinoxaline-2-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CCCCN(CCCOC1=NC2=CC=CC=C2N=C1C(=O)O)C3=NC=C(C=N3)CC
Isomeric SMILES
CCCCN(CCCOC1=NC2=CC=CC=C2N=C1C(=O)O)C3=NC=C(C=N3)CC
InChI
InChI=1S/C22H27N5O3/c1-3-5-11-27(22-23-14-16(4-2)15-24-22)12-8-13-30-20-19(21(28)29)25-17-9-6-7-10-18(17)26-20/h6-7,9-10,14-15H,3-5,8,11-13H2,1-2H3,(H,28,29)
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