sodium methyl-[1-(6-quinolin-8-ylsulfanylpyridazin-3-yl)imidazol-2-yl]phosphinate

Systemtic Name: sodium methyl-[1-(6-quinolin-8-ylsulfanylpyridazin-3-yl)imidazol-2-yl]phosphinate Openeye Name: sodium methyl-[1-[6-(8-quinolylsulfanyl)pyridazin-3-yl]imidazol-2-yl]phosphinate CAS Name: sodium methyl-[1-[6-(8-quinolinylthio)-3-pyridazinyl]-2-imidazolyl]phosphinate IUPAC Name: sodium methyl-[1-(6-quinolin-8-ylsulfanylpyridazin-3-yl)imidazol-2-yl]phosphinate Traditional Name: sodium methyl-[1-[6-(8-quinolylthio)pyridazin-3-yl]imidazol-2-yl]phosphinate Formula: C17H13N5NaO2PS MolecularWeight: 405.345951

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Descriptors Computed from Structure

Canonical SMILES:

CP(=O)(C1=NC=CN1C2=NN=C(C=C2)SC3=CC=CC4=C3N=CC=C4)[O-].[Na+]

Isomeric SMILES

CP(=O)(C1=NC=CN1C2=NN=C(C=C2)SC3=CC=CC4=C3N=CC=C4)[O-].[Na+]

InChI

InChI=1S/C17H14N5O2PS.Na/c1-25(23,24)17-19-10-11-22(17)14-7-8-15(21-20-14)26-13-6-2-4-12-5-3-9-18-16(12)13;/h2-11H,1H3,(H,23,24);/q;+1/p-1