4-(2-methylsulfanyl-5-nitro-6-prop-2-enoxy-pyrimidin-4-yl)-1,4-thiazinane 1,1-dioxide

Systemtic Name: 4-(2-methylsulfanyl-5-nitro-6-prop-2-enoxy-pyrimidin-4-yl)-1,4-thiazinane 1,1-dioxide Openeye Name: 4-(6-allyloxy-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)-1,4-thiazinane 1,1-dioxide CAS Name: 4-[2-(methylthio)-5-nitro-6-prop-2-enoxy-4-pyrimidinyl]-1,4-thiazinane 1,1-dioxide IUPAC Name: 4-(2-methylsulfanyl-5-nitro-6-prop-2-enoxypyrimidin-4-yl)-1,4-thiazinane 1,1-dioxide Traditional Name: 4-[6-allyloxy-2-(methylthio)-5-nitro-pyrimidin-4-yl]-1,4-thiazinane 1,1-dioxide Formula: C12H16N4O5S2 MolecularWeight: 360.40924

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)OCC=C)[N+](=O)[O-])N2CCS(=O)(=O)CC2

Isomeric SMILES

CSC1=NC(=C(C(=N1)OCC=C)[N+](=O)[O-])N2CCS(=O)(=O)CC2

InChI

InChI=1S/C12H16N4O5S2/c1-3-6-21-11-9(16(17)18)10(13-12(14-11)22-2)15-4-7-23(19,20)8-5-15/h3H,1,4-8H2,2H3