(6Z)-6-[[2-(4-nitrophenyl)ethylamino]-oxidanyl-methylidene]-2-thiophen-2-yl-1H-pyrimidine-4,5-dione

Systemtic Name: (6Z)-6-[[2-(4-nitrophenyl)ethylamino]-oxidanyl-methylidene]-2-thiophen-2-yl-1H-pyrimidine-4,5-dione Openeye Name: (6Z)-6-[hydroxy-[2-(4-nitrophenyl)ethylamino]methylene]-2-(2-thienyl)-1H-pyrimidine-4,5-dione CAS Name: (6Z)-6-[hydroxy-[2-(4-nitrophenyl)ethylamino]methylidene]-2-thiophen-2-yl-1H-pyrimidine-4,5-dione IUPAC Name: (6Z)-6-[hydroxy-[2-(4-nitrophenyl)ethylamino]methylidene]-2-thiophen-2-yl-1H-pyrimidine-4,5-dione Traditional Name: (6Z)-6-[hydroxy-[2-(4-nitrophenyl)ethylamino]methylene]-2-(2-thienyl)-1H-pyrimidine-4,5-quinone Formula: C17H14N4O5S MolecularWeight: 386.38186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=O)C(=O)C(=C(NCCC3=CC=C(C=C3)[N+](=O)[O-])O)N2

Isomeric SMILES

C1=CSC(=C1)C2=NC(=O)C(=O)/C(=C(\NCCC3=CC=C(C=C3)[N+](=O)[O-])/O)/N2

InChI

InChI=1S/C17H14N4O5S/c22-14-13(19-15(20-17(14)24)12-2-1-9-27-12)16(23)18-8-7-10-3-5-11(6-4-10)21(25)26/h1-6,9,18,23H,7-8H2,(H,19,20,24)/b16-13-