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(4-butoxy-5-nitro-6-thiomorpholin-4-yl-pyrimidin-2-yl)sulfanylmethanolate
(4-butoxy-5-nitro-6-thiomorpholin-4-yl-pyrimidin-2-yl)sulfanylmethanolate
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Descriptors Computed from Structure
Canonical SMILES:
CCCCOC1=NC(=NC(=C1[N+](=O)[O-])N2CCSCC2)SC[O-]
Isomeric SMILES
CCCCOC1=NC(=NC(=C1[N+](=O)[O-])N2CCSCC2)SC[O-]
InChI
InChI=1S/C13H19N4O4S2/c1-2-3-6-21-12-10(17(19)20)11(14-13(15-12)23-9-18)16-4-7-22-8-5-16/h2-9H2,1H3/q-1
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