3-[5-[butylsulfanyl(ethoxy)phosphinothioyl]oxy-3-methyl-pyrazol-1-yl]-2-methyl-propanenitrile

Systemtic Name: 3-[5-[butylsulfanyl(ethoxy)phosphinothioyl]oxy-3-methyl-pyrazol-1-yl]-2-methyl-propanenitrile Openeye Name: 3-[5-[butylsulfanyl(ethoxy)phosphinothioyl]oxy-3-methyl-pyrazol-1-yl]-2-methyl-propanenitrile CAS Name: 3-[5-[(butylthio)-ethoxyphosphinothioyl]oxy-3-methyl-1-pyrazolyl]-2-methylpropanenitrile IUPAC Name: 3-[5-[butylsulfanyl(ethoxy)phosphinothioyl]oxy-3-methylpyrazol-1-yl]-2-methylpropanenitrile Traditional Name: 3-[5-[(butylthio)-ethoxy-thiophosphoryl]oxy-3-methyl-pyrazol-1-yl]-2-methyl-propionitrile Formula: C14H24N3O2PS2 MolecularWeight: 361.463021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSP(=S)(OCC)OC1=CC(=NN1CC(C)C#N)C

Isomeric SMILES

CCCCSP(=S)(OCC)OC1=CC(=NN1CC(C)C#N)C

InChI

InChI=1S/C14H24N3O2PS2/c1-5-7-8-22-20(21,18-6-2)19-14-9-13(4)16-17(14)11-12(3)10-15/h9,12H,5-8,11H2,1-4H3