(6E)-6-[[(2-methoxyphenyl)methylamino]-oxidanyl-methylidene]-2-(5-nitrothiophen-2-yl)-1H-pyrimidine-4,5-dione

Systemtic Name: (6E)-6-[[(2-methoxyphenyl)methylamino]-oxidanyl-methylidene]-2-(5-nitrothiophen-2-yl)-1H-pyrimidine-4,5-dione Openeye Name: (6E)-6-[hydroxy-[(2-methoxyphenyl)methylamino]methylene]-2-(5-nitro-2-thienyl)-1H-pyrimidine-4,5-dione CAS Name: (6E)-6-[hydroxy-[(2-methoxyphenyl)methylamino]methylidene]-2-(5-nitro-2-thiophenyl)-1H-pyrimidine-4,5-dione IUPAC Name: (6E)-6-[hydroxy-[(2-methoxyphenyl)methylamino]methylidene]-2-(5-nitrothiophen-2-yl)-1H-pyrimidine-4,5-dione Traditional Name: (6E)-6-[hydroxy-(o-anisylamino)methylene]-2-(5-nitro-2-thienyl)-1H-pyrimidine-4,5-quinone Formula: C17H14N4O6S MolecularWeight: 402.38126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=C2C(=O)C(=O)N=C(N2)C3=CC=C(S3)[N+](=O)[O-])O

Isomeric SMILES

COC1=CC=CC=C1CN/C(=C\2/C(=O)C(=O)N=C(N2)C3=CC=C(S3)[N+](=O)[O-])/O

InChI

InChI=1S/C17H14N4O6S/c1-27-10-5-3-2-4-9(10)8-18-16(23)13-14(22)17(24)20-15(19-13)11-6-7-12(28-11)21(25)26/h2-7,18,23H,8H2,1H3,(H,19,20,24)/b16-13+