[(5S)-3-[3-fluoranyl-4-[methyl-[(5-nitropyrimidin-2-yl)methyl]amino]phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methylcarbamothioic S-acid

Systemtic Name: [(5S)-3-[3-fluoranyl-4-[methyl-[(5-nitropyrimidin-2-yl)methyl]amino]phenyl]-2-oxidanylidene-1,3-oxazolidin-5-yl]methylcarbamothioic S-acid Openeye Name: [(5S)-3-[3-fluoro-4-[methyl-[(5-nitropyrimidin-2-yl)methyl]amino]phenyl]-2-oxo-oxazolidin-5-yl]methylcarbamothioic S-acid CAS Name: [(5S)-3-[3-fluoro-4-[methyl-[(5-nitro-2-pyrimidinyl)methyl]amino]phenyl]-2-oxo-5-oxazolidinyl]methylcarbamothioic S-acid IUPAC Name: [(5S)-3-[3-fluoro-4-[methyl-[(5-nitropyrimidin-2-yl)methyl]amino]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methylcarbamothioic S-acid Traditional Name: [(5S)-3-[3-fluoro-4-[methyl-[(5-nitropyrimidin-2-yl)methyl]amino]phenyl]-2-keto-oxazolidin-5-yl]methylthiocarbamic S-acid Formula: C17H17FN6O5S MolecularWeight: 436.417483

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC=C(C=N1)[N+](=O)[O-])C2=C(C=C(C=C2)N3CC(OC3=O)CNC(=O)S)F

Isomeric SMILES

CN(CC1=NC=C(C=N1)[N+](=O)[O-])C2=C(C=C(C=C2)N3C[C@@H](OC3=O)CNC(=O)S)F

InChI

InChI=1S/C17H17FN6O5S/c1-22(9-15-19-5-11(6-20-15)24(27)28)14-3-2-10(4-13(14)18)23-8-12(29-17(23)26)7-21-16(25)30/h2-6,12H,7-9H2,1H3,(H2,21,25,30)/t12-/m0/s1