5-nitro-2-pyrimidin-2-ylsulfanyl-pyridine-3-carboxylic acid

Systemtic Name: 5-nitro-2-pyrimidin-2-ylsulfanyl-pyridine-3-carboxylic acid Openeye Name: 5-nitro-2-pyrimidin-2-ylsulfanyl-pyridine-3-carboxylic acid CAS Name: 5-nitro-2-(2-pyrimidinylthio)-3-pyridinecarboxylic acid IUPAC Name: 5-nitro-2-pyrimidin-2-ylsulfanylpyridine-3-carboxylic acid Traditional Name: 5-nitro-2-(2-pyrimidylthio)nicotinic acid Formula: C10H6N4O4S MolecularWeight: 278.24404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SC2=NC=C(C=C2C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CN=C(N=C1)SC2=NC=C(C=C2C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H6N4O4S/c15-9(16)7-4-6(14(17)18)5-13-8(7)19-10-11-2-1-3-12-10/h1-5H,(H,15,16)