2-(3-nitropyridin-2-yl)sulfanyl-1H-pyrimidin-6-one

Systemtic Name: 2-(3-nitropyridin-2-yl)sulfanyl-1H-pyrimidin-6-one Openeye Name: 2-[(3-nitro-2-pyridyl)sulfanyl]-1H-pyrimidin-6-one CAS Name: 2-[(3-nitro-2-pyridinyl)thio]-1H-pyrimidin-6-one IUPAC Name: 2-(3-nitropyridin-2-yl)sulfanyl-1H-pyrimidin-6-one Traditional Name: 2-[(3-nitro-2-pyridyl)thio]-1H-pyrimidin-6-one Formula: C9H6N4O3S MolecularWeight: 250.23394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SC2=NC=CC(=O)N2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)SC2=NC=CC(=O)N2)[N+](=O)[O-]

InChI

InChI=1S/C9H6N4O3S/c14-7-3-5-11-9(12-7)17-8-6(13(15)16)2-1-4-10-8/h1-5H,(H,11,12,14)