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

Systemtic Name: (6Z)-6-[(1H-imidazol-2-ylmethylamino)-oxidanyl-methylidene]-2-thiophen-2-yl-1H-pyrimidine-4,5-dione Openeye Name: (6Z)-6-[hydroxy-(1H-imidazol-2-ylmethylamino)methylene]-2-(2-thienyl)-1H-pyrimidine-4,5-dione CAS Name: (6Z)-6-[hydroxy-(1H-imidazol-2-ylmethylamino)methylidene]-2-thiophen-2-yl-1H-pyrimidine-4,5-dione IUPAC Name: (6Z)-6-[hydroxy-(1H-imidazol-2-ylmethylamino)methylidene]-2-thiophen-2-yl-1H-pyrimidine-4,5-dione Traditional Name: (6Z)-6-[hydroxy-(1H-imidazol-2-ylmethylamino)methylene]-2-(2-thienyl)-1H-pyrimidine-4,5-quinone Formula: C13H11N5O3S MolecularWeight: 317.32314

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=O)C(=O)C(=C(NCC3=NC=CN3)O)N2

Isomeric SMILES

C1=CSC(=C1)C2=NC(=O)C(=O)/C(=C(\NCC3=NC=CN3)/O)/N2

InChI

InChI=1S/C13H11N5O3S/c19-10-9(12(20)16-6-8-14-3-4-15-8)17-11(18-13(10)21)7-2-1-5-22-7/h1-5,16,20H,6H2,(H,14,15)(H,17,18,21)/b12-9-