(4-butoxy-5-nitro-6-thiomorpholin-4-yl-pyrimidin-2-yl)sulfanylmethanol

Systemtic Name: (4-butoxy-5-nitro-6-thiomorpholin-4-yl-pyrimidin-2-yl)sulfanylmethanol Openeye Name: (4-butoxy-5-nitro-6-thiomorpholino-pyrimidin-2-yl)sulfanylmethanol CAS Name: [(4-butoxy-5-nitro-6-thiomorpholin-4-yl-2-pyrimidinyl)thio]methanol IUPAC Name: (4-butoxy-5-nitro-6-thiomorpholin-4-ylpyrimidin-2-yl)sulfanylmethanol Traditional Name: [(4-butoxy-5-nitro-6-thiomorpholino-pyrimidin-2-yl)thio]methanol Formula: C13H20N4O4S2 MolecularWeight: 360.4523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC(=NC(=C1[N+](=O)[O-])N2CCSCC2)SCO

Isomeric SMILES

CCCCOC1=NC(=NC(=C1[N+](=O)[O-])N2CCSCC2)SCO

InChI

InChI=1S/C13H20N4O4S2/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/h18H,2-9H2,1H3