(2,6-dimethoxypyrimidin-4-yl)-[4-[(5-nitrofuran-2-yl)carbonylamino]phenyl]sulfonyl-azanide

Systemtic Name: (2,6-dimethoxypyrimidin-4-yl)-[4-[(5-nitrofuran-2-yl)carbonylamino]phenyl]sulfonyl-azanide Openeye Name: (2,6-dimethoxypyrimidin-4-yl)-[4-[(5-nitrofuran-2-carbonyl)amino]phenyl]sulfonyl-azanide CAS Name: (2,6-dimethoxy-4-pyrimidinyl)-[4-[[(5-nitro-2-furanyl)-oxomethyl]amino]phenyl]sulfonylazanide IUPAC Name: (2,6-dimethoxypyrimidin-4-yl)-[4-[(5-nitrofuran-2-carbonyl)amino]phenyl]sulfonylazanide Traditional Name: (2,6-dimethoxypyrimidin-4-yl)-[4-[(5-nitro-2-furoyl)amino]phenyl]sulfonyl-azanide Formula: C17H14N5O8S- MolecularWeight: 448.38676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(O3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=NC(=NC(=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(O3)[N+](=O)[O-])OC

InChI

InChI=1S/C17H15N5O8S/c1-28-14-9-13(19-17(20-14)29-2)21-31(26,27)11-5-3-10(4-6-11)18-16(23)12-7-8-15(30-12)22(24)25/h3-9H,1-2H3,(H2,18,19,20,21,23)/p-1