azanium (4-cyano-3-fluoranyl-phenoxy)-[[[5-(6-methoxypyridin-3-yl)thiophen-2-yl]sulfonylamino]methyl]phosphinate

Systemtic Name: azanium (4-cyano-3-fluoranyl-phenoxy)-[[[5-(6-methoxypyridin-3-yl)thiophen-2-yl]sulfonylamino]methyl]phosphinate Openeye Name: ammonium (4-cyano-3-fluoro-phenoxy)-[[[5-(6-methoxy-3-pyridyl)-2-thienyl]sulfonylamino]methyl]phosphinate CAS Name: ammonium (4-cyano-3-fluorophenoxy)-[[[5-(6-methoxy-3-pyridinyl)-2-thiophenyl]sulfonylamino]methyl]phosphinate IUPAC Name: azanium (4-cyano-3-fluorophenoxy)-[[[5-(6-methoxypyridin-3-yl)thiophen-2-yl]sulfonylamino]methyl]phosphinate Traditional Name: ammonium (4-cyano-3-fluoro-phenoxy)-[[[5-(6-methoxy-3-pyridyl)-2-thienyl]sulfonylamino]methyl]phosphinate Formula: C18H18FN4O6PS2 MolecularWeight: 500.460884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)C2=CC=C(S2)S(=O)(=O)NCP(=O)([O-])OC3=CC(=C(C=C3)C#N)F.[NH4+]

Isomeric SMILES

COC1=NC=C(C=C1)C2=CC=C(S2)S(=O)(=O)NCP(=O)([O-])OC3=CC(=C(C=C3)C#N)F.[NH4+]

InChI

InChI=1S/C18H15FN3O6PS2.H3N/c1-27-17-6-3-13(10-21-17)16-5-7-18(30-16)31(25,26)22-11-29(23,24)28-14-4-2-12(9-20)15(19)8-14;/h2-8,10,22H,11H2,1H3,(H,23,24);1H3