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

Systemtic Name: 6-azanyl-5-nitro-2-pyrimidin-2-ylsulfanyl-pyridine-3-carboxylic acid Openeye Name: 6-amino-5-nitro-2-pyrimidin-2-ylsulfanyl-pyridine-3-carboxylic acid CAS Name: 6-amino-5-nitro-2-(2-pyrimidinylthio)-3-pyridinecarboxylic acid IUPAC Name: 6-amino-5-nitro-2-pyrimidin-2-ylsulfanylpyridine-3-carboxylic acid Traditional Name: 6-amino-5-nitro-2-(2-pyrimidylthio)nicotinic acid Formula: C10H7N5O4S MolecularWeight: 293.25868

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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-])N

Isomeric SMILES

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

InChI

InChI=1S/C10H7N5O4S/c11-7-6(15(18)19)4-5(9(16)17)8(14-7)20-10-12-2-1-3-13-10/h1-4H,(H2,11,14)(H,16,17)