6-(3-nitrophenyl)-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 6-(3-nitrophenyl)-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 6-(3-nitrophenyl)-2-thioxo-1H-pyrimidin-4-one CAS Name: 6-(3-nitrophenyl)-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 6-(3-nitrophenyl)-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 6-(3-nitrophenyl)-2-thioxo-1H-pyrimidin-4-one Formula: C10H7N3O3S MolecularWeight: 249.24588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=O)NC(=S)N2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC(=O)NC(=S)N2

InChI

InChI=1S/C10H7N3O3S/c14-9-5-8(11-10(17)12-9)6-2-1-3-7(4-6)13(15)16/h1-5H,(H2,11,12,14,17)