4-(2-chloranyl-5-nitro-pyrimidin-4-yl)-4-oxidanidyl-thiomorpholin-4-ium

Systemtic Name: 4-(2-chloranyl-5-nitro-pyrimidin-4-yl)-4-oxidanidyl-thiomorpholin-4-ium Openeye Name: 4-(2-chloro-5-nitro-pyrimidin-4-yl)-4-oxido-thiomorpholin-4-ium CAS Name: 4-(2-chloro-5-nitro-4-pyrimidinyl)-4-oxidothiomorpholin-4-ium IUPAC Name: 4-(2-chloro-5-nitropyrimidin-4-yl)-4-oxidothiomorpholin-4-ium Traditional Name: 4-(2-chloro-5-nitro-pyrimidin-4-yl)-4-oxido-thiomorpholin-4-ium Formula: C8H9ClN4O3S MolecularWeight: 276.70006

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC[N+]1(C2=NC(=NC=C2[N+](=O)[O-])Cl)[O-]

Isomeric SMILES

C1CSCC[N+]1(C2=NC(=NC=C2[N+](=O)[O-])Cl)[O-]

InChI

InChI=1S/C8H9ClN4O3S/c9-8-10-5-6(12(14)15)7(11-8)13(16)1-3-17-4-2-13/h5H,1-4H2