4-(6-butan-2-yloxy-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)-1,4-thiazinane 1-oxide

Systemtic Name: 4-(6-butan-2-yloxy-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)-1,4-thiazinane 1-oxide Openeye Name: 4-(2-methylsulfanyl-5-nitro-6-sec-butoxy-pyrimidin-4-yl)-1,4-thiazinane 1-oxide CAS Name: 4-[6-butan-2-yloxy-2-(methylthio)-5-nitro-4-pyrimidinyl]-1,4-thiazinane 1-oxide IUPAC Name: 4-(6-butan-2-yloxy-2-methylsulfanyl-5-nitropyrimidin-4-yl)-1,4-thiazinane 1-oxide Traditional Name: 4-[2-(methylthio)-5-nitro-6-sec-butoxy-pyrimidin-4-yl]-1,4-thiazinane 1-oxide Formula: C13H20N4O4S2 MolecularWeight: 360.4523

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=NC(=NC(=C1[N+](=O)[O-])N2CCS(=O)CC2)SC

Isomeric SMILES

CCC(C)OC1=NC(=NC(=C1[N+](=O)[O-])N2CCS(=O)CC2)SC

InChI

InChI=1S/C13H20N4O4S2/c1-4-9(2)21-12-10(17(18)19)11(14-13(15-12)22-3)16-5-7-23(20)8-6-16/h9H,4-8H2,1-3H3