1-[4,6-bis(chloranyl)-5-nitro-pyrimidin-2-yl]propane-2-thione

Systemtic Name: 1-[4,6-bis(chloranyl)-5-nitro-pyrimidin-2-yl]propane-2-thione Openeye Name: 1-(4,6-dichloro-5-nitro-pyrimidin-2-yl)propane-2-thione CAS Name: 1-(4,6-dichloro-5-nitro-2-pyrimidinyl)-2-propanethione IUPAC Name: 1-(4,6-dichloro-5-nitropyrimidin-2-yl)propane-2-thione Traditional Name: 1-(4,6-dichloro-5-nitro-pyrimidin-2-yl)propane-2-thione Formula: C7H5Cl2N3O2S MolecularWeight: 266.1045

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)CC1=NC(=C(C(=N1)Cl)[N+](=O)[O-])Cl

Isomeric SMILES

CC(=S)CC1=NC(=C(C(=N1)Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C7H5Cl2N3O2S/c1-3(15)2-4-10-6(8)5(12(13)14)7(9)11-4/h2H2,1H3